lovingscience/chembl-v37-raw-activities huggingface dataset:
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Thiosulfate sulfurtransferase (SINGLE PROTEIN), Homo sapiens
UniProt: Q16762
Assay: Binding affinity to human TST incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 39.84 nM (pChEMBL 7.400000095367432)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tetratricopeptide repeat protein 14 (SINGLE PROTEIN), Homo sapiens
UniProt: Q96N46
Assay: Binding affinity to human TTC14 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 2317.3 nM (pChEMBL 5.630000114440918)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tetratricopeptide repeat protein 14 (SINGLE PROTEIN), Homo sapiens
UniProt: Q96N46
Assay: Binding affinity to human TTC14 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 2317.3 nM (pChEMBL 5.630000114440918)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Superkiller complex protein 3 (SINGLE PROTEIN), Homo sapiens
UniProt: Q6PGP7
Assay: Binding affinity to human TTC37 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 4.399 nM (pChEMBL 8.359999656677246)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Superkiller complex protein 3 (SINGLE PROTEIN), Homo sapiens
UniProt: Q6PGP7
Assay: Binding affinity to human TTC37 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 4.399 nM (pChEMBL 8.359999656677246)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: TELO2-interacting protein 1 homolog (SINGLE PROTEIN), Homo sapiens
UniProt: O43156
Assay: Binding affinity to human TTI1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 1.175 nM (pChEMBL 8.930000305175781)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: TELO2-interacting protein 1 homolog (SINGLE PROTEIN), Homo sapiens
UniProt: O43156
Assay: Binding affinity to human TTI1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1.175 nM (pChEMBL 8.930000305175781)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: TELO2-interacting protein 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q6NXR4
Assay: Binding affinity to human TTI2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 12981.52 nM (pChEMBL 4.889999866485596)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: TELO2-interacting protein 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q6NXR4
Assay: Binding affinity to human TTI2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 12981.52 nM (pChEMBL 4.889999866485596)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Dual specificity protein kinase TTK (SINGLE PROTEIN), Homo sapiens
UniProt: P33981
Assay: Binding affinity to human TTK incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 54411.31 nM (pChEMBL 4.260000228881836)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Dual specificity protein kinase TTK (SINGLE PROTEIN), Homo sapiens
UniProt: P33981
Assay: Binding affinity to human TTK incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 54411.31 nM (pChEMBL 4.260000228881836)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin--tyrosine ligase-like protein 12 (SINGLE PROTEIN), Homo sapiens
UniProt: Q14166
Assay: Binding affinity to human TTLL12 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 7966.91 nM (pChEMBL 5.099999904632568)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin--tyrosine ligase-like protein 12 (SINGLE PROTEIN), Homo sapiens
UniProt: Q14166
Assay: Binding affinity to human TTLL12 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 7966.91 nM (pChEMBL 5.099999904632568)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Titin (SINGLE PROTEIN), Homo sapiens
UniProt: Q8WZ42
Assay: Binding affinity to human TTN incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 11.93 nM (pChEMBL 7.920000076293945)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Titin (SINGLE PROTEIN), Homo sapiens
UniProt: Q8WZ42
Assay: Binding affinity to human TTN incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 12.56 nM (pChEMBL 7.900000095367432)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin alpha-1B chain (SINGLE PROTEIN), Homo sapiens
UniProt: P68363
Assay: Binding affinity to human TUBA1B incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 3873.52 nM (pChEMBL 5.409999847412109)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin alpha-1B chain (SINGLE PROTEIN), Homo sapiens
UniProt: P68363
Assay: Binding affinity to human TUBA1B incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 3873.52 nM (pChEMBL 5.409999847412109)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin alpha-1C chain (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BQE3
Assay: Binding affinity to human TUBA1C incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 8527.72 nM (pChEMBL 5.070000171661377)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin alpha-1C chain (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BQE3
Assay: Binding affinity to human TUBA1C incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 9374.41 nM (pChEMBL 5.03000020980835)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin alpha-8 chain (SINGLE PROTEIN), Homo sapiens
UniProt: Q9NY65
Assay: Binding affinity to human TUBA8 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 4818.06 nM (pChEMBL 5.320000171661377)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin alpha-8 chain (SINGLE PROTEIN), Homo sapiens
UniProt: Q9NY65
Assay: Binding affinity to human TUBA8 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 4818.06 nM (pChEMBL 5.320000171661377)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin beta-5 chain (SINGLE PROTEIN), Homo sapiens
UniProt: P07437
Assay: Binding affinity to human TUBB incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 9.047 nM (pChEMBL 8.039999961853027)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin beta-5 chain (SINGLE PROTEIN), Homo sapiens
UniProt: P07437
Assay: Binding affinity to human TUBB incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 9.047 nM (pChEMBL 8.039999961853027)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin beta-2B chain (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BVA1
Assay: Binding affinity to human TUBB2B incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 14.03 nM (pChEMBL 7.849999904632568)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin beta-2B chain (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BVA1
Assay: Binding affinity to human TUBB2B incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 14.03 nM (pChEMBL 7.849999904632568)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin beta-3 chain (SINGLE PROTEIN), Homo sapiens
UniProt: Q13509
Assay: Binding affinity to human TUBB3 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 106.25 nM (pChEMBL 6.96999979019165)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin beta-3 chain (SINGLE PROTEIN), Homo sapiens
UniProt: Q13509
Assay: Binding affinity to human TUBB3 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 106.25 nM (pChEMBL 6.96999979019165)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin beta-4B chain (SINGLE PROTEIN), Homo sapiens
UniProt: P68371
Assay: Binding affinity to human TUBB4B incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 1.201 nM (pChEMBL 8.920000076293945)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin beta-4B chain (SINGLE PROTEIN), Homo sapiens
UniProt: P68371
Assay: Binding affinity to human TUBB4B incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1.201 nM (pChEMBL 8.920000076293945)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin beta-6 chain (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BUF5
Assay: Binding affinity to human TUBB6 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 4669.48 nM (pChEMBL 5.329999923706055)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin beta-6 chain (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BUF5
Assay: Binding affinity to human TUBB6 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 4669.48 nM (pChEMBL 5.329999923706055)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin beta-8 chain (SINGLE PROTEIN), Homo sapiens
UniProt: Q3ZCM7
Assay: Binding affinity to human TUBB8 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 4415.65 nM (pChEMBL 5.360000133514404)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Tubulin beta-8 chain (SINGLE PROTEIN), Homo sapiens
UniProt: Q3ZCM7
Assay: Binding affinity to human TUBB8 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 5359.99 nM (pChEMBL 5.269999980926514)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Gamma-tubulin complex component 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BSJ2
Assay: Binding affinity to human TUBGCP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 40.1 nM (pChEMBL 7.400000095367432)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Gamma-tubulin complex component 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BSJ2
Assay: Binding affinity to human TUBGCP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 40.14 nM (pChEMBL 7.400000095367432)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Gamma-tubulin complex component 3 (SINGLE PROTEIN), Homo sapiens
UniProt: Q96CW5
Assay: Binding affinity to human TUBGCP3 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 1.734 nM (pChEMBL 8.760000228881836)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Gamma-tubulin complex component 3 (SINGLE PROTEIN), Homo sapiens
UniProt: Q96CW5
Assay: Binding affinity to human TUBGCP3 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1.734 nM (pChEMBL 8.760000228881836)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Gamma-tubulin complex component 4 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UGJ1
Assay: Binding affinity to human TUBGCP4 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 735.57 nM (pChEMBL 6.130000114440918)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Gamma-tubulin complex component 4 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UGJ1
Assay: Binding affinity to human TUBGCP4 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 895.06 nM (pChEMBL 6.050000190734863)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Elongation factor Tu, mitochondrial (SINGLE PROTEIN), Homo sapiens
UniProt: P49411
Assay: Binding affinity to human TUFM incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 32748.86 nM (pChEMBL 4.489999771118164)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Elongation factor Tu, mitochondrial (SINGLE PROTEIN), Homo sapiens
UniProt: P49411
Assay: Binding affinity to human TUFM incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 32748.86 nM (pChEMBL 4.489999771118164)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Twinfilin-2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q6IBS0
Assay: Binding affinity to human TWF2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 17557.74 nM (pChEMBL 4.760000228881836)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Twinfilin-2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q6IBS0
Assay: Binding affinity to human TWF2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 20490.49 nM (pChEMBL 4.690000057220459)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Alpha-taxilin (SINGLE PROTEIN), Homo sapiens
UniProt: P40222
Assay: Binding affinity to human TXLNA incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 3538.64 nM (pChEMBL 5.449999809265137)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Alpha-taxilin (SINGLE PROTEIN), Homo sapiens
UniProt: P40222
Assay: Binding affinity to human TXLNA incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 3538.64 nM (pChEMBL 5.449999809265137)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Thioredoxin (SINGLE PROTEIN), Homo sapiens
UniProt: P10599
Assay: Binding affinity to human TXN incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 11430.1 nM (pChEMBL 4.940000057220459)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Thioredoxin (SINGLE PROTEIN), Homo sapiens
UniProt: P10599
Assay: Binding affinity to human TXN incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 11430.1 nM (pChEMBL 4.940000057220459)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Thioredoxin domain-containing protein 17 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BRA2
Assay: Binding affinity to human TXNDC17 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 164054.48 nM (pChEMBL 3.7899999618530273)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Thioredoxin domain-containing protein 5 (SINGLE PROTEIN), Homo sapiens
UniProt: Q8NBS9
Assay: Binding affinity to human TXNDC5 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 496.2 nM (pChEMBL 6.300000190734863)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Thioredoxin domain-containing protein 5 (SINGLE PROTEIN), Homo sapiens
UniProt: Q8NBS9
Assay: Binding affinity to human TXNDC5 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 496.2 nM (pChEMBL 6.300000190734863)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Thioredoxin-like protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: O43396
Assay: Binding affinity to human TXNL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 259.83 nM (pChEMBL 6.579999923706055)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Thioredoxin-like protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: O43396
Assay: Binding affinity to human TXNL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 259.83 nM (pChEMBL 6.579999923706055)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Thioredoxin reductase 1, cytoplasmic (SINGLE PROTEIN), Homo sapiens
UniProt: Q16881
Assay: Binding affinity to human TXNRD1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 189.99 nM (pChEMBL 6.71999979019165)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Thioredoxin reductase 1, cytoplasmic (SINGLE PROTEIN), Homo sapiens
UniProt: Q16881
Assay: Binding affinity to human TXNRD1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 189.99 nM (pChEMBL 6.71999979019165)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Non-receptor tyrosine-protein kinase TYK2 (SINGLE PROTEIN), Homo sapiens
UniProt: P29597
Assay: Binding affinity to human TYK2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 588.05 nM (pChEMBL 6.230000019073486)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Non-receptor tyrosine-protein kinase TYK2 (SINGLE PROTEIN), Homo sapiens
UniProt: P29597
Assay: Binding affinity to human TYK2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1127.82 nM (pChEMBL 5.949999809265137)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Splicing factor U2AF 35 kDa subunit (SINGLE PROTEIN), Homo sapiens
UniProt: Q01081
Assay: Binding affinity to human U2AF1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 137.44 nM (pChEMBL 6.860000133514404)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Splicing factor U2AF 35 kDa subunit (SINGLE PROTEIN), Homo sapiens
UniProt: Q01081
Assay: Binding affinity to human U2AF1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 137.44 nM (pChEMBL 6.860000133514404)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Splicing factor U2AF 65 kDa subunit (SINGLE PROTEIN), Homo sapiens
UniProt: P26368
Assay: Binding affinity to human U2AF2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 501.01 nM (pChEMBL 6.300000190734863)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Splicing factor U2AF 65 kDa subunit (SINGLE PROTEIN), Homo sapiens
UniProt: P26368
Assay: Binding affinity to human U2AF2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 501.01 nM (pChEMBL 6.300000190734863)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: U2 snRNP-associated SURP motif-containing protein (SINGLE PROTEIN), Homo sapiens
UniProt: O15042
Assay: Binding affinity to human U2SURP incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 1911.05 nM (pChEMBL 5.71999979019165)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: U2 snRNP-associated SURP motif-containing protein (SINGLE PROTEIN), Homo sapiens
UniProt: O15042
Assay: Binding affinity to human U2SURP incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1911.05 nM (pChEMBL 5.71999979019165)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Uveal autoantigen with coiled-coil domains and ankyrin repeats (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BZF9
Assay: Binding affinity to human UACA incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 1611.91 nM (pChEMBL 5.789999961853027)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Uveal autoantigen with coiled-coil domains and ankyrin repeats (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BZF9
Assay: Binding affinity to human UACA incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1611.91 nM (pChEMBL 5.789999961853027)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-like modifier-activating enzyme 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P22314
Assay: Binding affinity to human UBA1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 92.91 nM (pChEMBL 7.03000020980835)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-like modifier-activating enzyme 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P22314
Assay: Binding affinity to human UBA1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 92.91 nM (pChEMBL 7.03000020980835)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: SUMO-activating enzyme subunit 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UBT2
Assay: Binding affinity to human UBA2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 20063.93 nM (pChEMBL 4.699999809265137)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: SUMO-activating enzyme subunit 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UBT2
Assay: Binding affinity to human UBA2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 20063.93 nM (pChEMBL 4.699999809265137)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: NEDD8-activating enzyme E1 catalytic subunit (SINGLE PROTEIN), Homo sapiens
UniProt: Q8TBC4
Assay: Binding affinity to human UBA3 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 121360.64 nM (pChEMBL 3.9200000762939453)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-associated protein 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q5T6F2
Assay: Binding affinity to human UBAP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 4501.74 nM (pChEMBL 5.349999904632568)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-associated protein 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q5T6F2
Assay: Binding affinity to human UBAP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 4501.74 nM (pChEMBL 5.349999904632568)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-associated protein 2-like (SINGLE PROTEIN), Homo sapiens
UniProt: Q14157
Assay: Binding affinity to human UBAP2L incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 14338.76 nM (pChEMBL 4.840000152587891)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-associated protein 2-like (SINGLE PROTEIN), Homo sapiens
UniProt: Q14157
Assay: Binding affinity to human UBAP2L incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 14338.76 nM (pChEMBL 4.840000152587891)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-associated and SH3 domain-containing protein B (SINGLE PROTEIN), Homo sapiens
UniProt: Q8TF42
Assay: Binding affinity to human UBASH3B incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 578.05 nM (pChEMBL 6.239999771118164)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-associated and SH3 domain-containing protein B (SINGLE PROTEIN), Homo sapiens
UniProt: Q8TF42
Assay: Binding affinity to human UBASH3B incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1171.52 nM (pChEMBL 5.929999828338623)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: SUMO-conjugating enzyme UBC9 (SINGLE PROTEIN), Homo sapiens
UniProt: P63279
Assay: Binding affinity to human UBE2I incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 290.72 nM (pChEMBL 6.539999961853027)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: SUMO-conjugating enzyme UBC9 (SINGLE PROTEIN), Homo sapiens
UniProt: P63279
Assay: Binding affinity to human UBE2I incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 290.72 nM (pChEMBL 6.539999961853027)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-conjugating enzyme E2 L3 (SINGLE PROTEIN), Homo sapiens
UniProt: P68036
Assay: Binding affinity to human UBE2L3 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 320.19 nM (pChEMBL 6.5)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-conjugating enzyme E2 L3 (SINGLE PROTEIN), Homo sapiens
UniProt: P68036
Assay: Binding affinity to human UBE2L3 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 320.19 nM (pChEMBL 6.5)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: NEDD8-conjugating enzyme Ubc12 (SINGLE PROTEIN), Homo sapiens
UniProt: P61081
Assay: Binding affinity to human UBE2M incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 107.85 nM (pChEMBL 6.96999979019165)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: NEDD8-conjugating enzyme Ubc12 (SINGLE PROTEIN), Homo sapiens
UniProt: P61081
Assay: Binding affinity to human UBE2M incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 107.85 nM (pChEMBL 6.96999979019165)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-conjugating enzyme E2 variant 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q13404
Assay: Binding affinity to human UBE2V1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 55475.2 nM (pChEMBL 4.260000228881836)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-conjugating enzyme E2 variant 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q13404
Assay: Binding affinity to human UBE2V1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 55475.2 nM (pChEMBL 4.260000228881836)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-protein ligase E3C (SINGLE PROTEIN), Homo sapiens
UniProt: Q15386
Assay: Binding affinity to human UBE3C incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 82.53 nM (pChEMBL 7.079999923706055)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-protein ligase E3C (SINGLE PROTEIN), Homo sapiens
UniProt: Q15386
Assay: Binding affinity to human UBE3C incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 83.64 nM (pChEMBL 7.079999923706055)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin conjugation factor E4 A (SINGLE PROTEIN), Homo sapiens
UniProt: Q14139
Assay: Binding affinity to human UBE4A incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 321.88 nM (pChEMBL 6.489999771118164)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin conjugation factor E4 A (SINGLE PROTEIN), Homo sapiens
UniProt: Q14139
Assay: Binding affinity to human UBE4A incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 376.87 nM (pChEMBL 6.420000076293945)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquilin-1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UMX0
Assay: Binding affinity to human UBQLN1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 0.598 nM (pChEMBL 9.220000267028809)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquilin-1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UMX0
Assay: Binding affinity to human UBQLN1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 0.627 nM (pChEMBL 9.199999809265137)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquilin-2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UHD9
Assay: Binding affinity to human UBQLN2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 27314.9 nM (pChEMBL 4.559999942779541)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquilin-2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UHD9
Assay: Binding affinity to human UBQLN2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 36948.71 nM (pChEMBL 4.429999828338623)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: E3 ubiquitin-protein ligase UBR4 (SINGLE PROTEIN), Homo sapiens
UniProt: Q5T4S7
Assay: Binding affinity to human UBR4 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 592.96 nM (pChEMBL 6.230000019073486)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: E3 ubiquitin-protein ligase UBR4 (SINGLE PROTEIN), Homo sapiens
UniProt: Q5T4S7
Assay: Binding affinity to human UBR4 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 592.96 nM (pChEMBL 6.230000019073486)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: UBX domain-containing protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q04323
Assay: Binding affinity to human UBXN1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 26032.73 nM (pChEMBL 4.579999923706055)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: UBX domain-containing protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q04323
Assay: Binding affinity to human UBXN1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 32890.35 nM (pChEMBL 4.480000019073486)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: UBX domain-containing protein 4 (SINGLE PROTEIN), Homo sapiens
UniProt: Q92575
Assay: Binding affinity to human UBXN4 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 5251.02 nM (pChEMBL 5.28000020980835)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: UBX domain-containing protein 4 (SINGLE PROTEIN), Homo sapiens
UniProt: Q92575
Assay: Binding affinity to human UBXN4 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 5251.02 nM (pChEMBL 5.28000020980835)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin carboxyl-terminal hydrolase isozyme L1 (SINGLE PROTEIN), Homo sapiens
UniProt: P09936
Assay: Binding affinity to human UCHL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 106.08 nM (pChEMBL 6.96999979019165)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin carboxyl-terminal hydrolase isozyme L1 (SINGLE PROTEIN), Homo sapiens
UniProt: P09936
Assay: Binding affinity to human UCHL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 106.08 nM (pChEMBL 6.96999979019165)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin carboxyl-terminal hydrolase isozyme L5 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9Y5K5
Assay: Binding affinity to human UCHL5 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 57.57 nM (pChEMBL 7.239999771118164)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin carboxyl-terminal hydrolase isozyme L5 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9Y5K5
Assay: Binding affinity to human UCHL5 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 57.57 nM (pChEMBL 7.239999771118164)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: E3 UFM1-protein ligase 1 (SINGLE PROTEIN), Homo sapiens
UniProt: O94874
Assay: Binding affinity to human UFL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 16.48 nM (pChEMBL 7.78000020980835)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: E3 UFM1-protein ligase 1 (SINGLE PROTEIN), Homo sapiens
UniProt: O94874
Assay: Binding affinity to human UFL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 16.48 nM (pChEMBL 7.78000020980835)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-fold modifier 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P61960
Assay: Binding affinity to human UFM1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 38.2 nM (pChEMBL 7.420000076293945)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Ubiquitin-fold modifier 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P61960
Assay: Binding affinity to human UFM1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 38.2 nM (pChEMBL 7.420000076293945)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: UDP-glucose 6-dehydrogenase (SINGLE PROTEIN), Homo sapiens
UniProt: O60701
Assay: Binding affinity to human UGDH incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1450064.85 nM (pChEMBL 2.8399999141693115)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: UDP-glucose:glycoprotein glucosyltransferase 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9NYU2
Assay: Binding affinity to human UGGT1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 43.45 nM (pChEMBL 7.360000133514404)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: UDP-glucose:glycoprotein glucosyltransferase 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9NYU2
Assay: Binding affinity to human UGGT1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 43.45 nM (pChEMBL 7.360000133514404)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: UTP--glucose-1-phosphate uridylyltransferase (SINGLE PROTEIN), Homo sapiens
UniProt: Q16851
Assay: Binding affinity to human UGP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 58458.23 nM (pChEMBL 4.230000019073486)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: UTP--glucose-1-phosphate uridylyltransferase (SINGLE PROTEIN), Homo sapiens
UniProt: Q16851
Assay: Binding affinity to human UGP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 58458.23 nM (pChEMBL 4.230000019073486)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Serine/threonine-protein kinase ULK1 (SINGLE PROTEIN), Homo sapiens
UniProt: O75385
Assay: Binding affinity to human ULK1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 367.72 nM (pChEMBL 6.429999828338623)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Serine/threonine-protein kinase ULK1 (SINGLE PROTEIN), Homo sapiens
UniProt: O75385
Assay: Binding affinity to human ULK1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 550.44 nM (pChEMBL 6.260000228881836)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Serine/threonine-protein kinase ULK2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q8IYT8
Assay: Binding affinity to human ULK2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 336453.33 nM (pChEMBL 3.4700000286102295)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32
Compound (SMILES): Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
InChIKey: MWKSRKSEWLRPBL-UHFFFAOYSA-N
Target: Serine/threonine-protein kinase ULK3 (SINGLE PROTEIN), Homo sapiens
UniProt: Q6PHR2
Assay: Binding affinity to human ULK3 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 35.61 nM (pChEMBL 7.449999809265137)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32