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: Insulin-like growth factor 2 mRNA-binding protein 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9Y6M1
Assay: Binding affinity to human IGF2BP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 14186448.53 nM (pChEMBL 1.850000023841858)
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: Insulin-like growth factor 2 mRNA-binding protein 3 (SINGLE PROTEIN), Homo sapiens
UniProt: O00425
Assay: Binding affinity to human IGF2BP3 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 1924.11 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: Insulin-like growth factor 2 mRNA-binding protein 3 (SINGLE PROTEIN), Homo sapiens
UniProt: O00425
Assay: Binding affinity to human IGF2BP3 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1924.11 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: Cation-independent mannose-6-phosphate receptor (SINGLE PROTEIN), Homo sapiens
UniProt: P11717
Assay: Binding affinity to human IGF2R incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 57.26 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: Cation-independent mannose-6-phosphate receptor (SINGLE PROTEIN), Homo sapiens
UniProt: P11717
Assay: Binding affinity to human IGF2R incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 57.26 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: Protein Red (SINGLE PROTEIN), Homo sapiens
UniProt: Q13123
Assay: Binding affinity to human IK incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 160257.11 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: Elongator complex protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: O95163
Assay: Binding affinity to human IKBKAP incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 89.95 nM (pChEMBL 7.050000190734863)
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: Elongator complex protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: O95163
Assay: Binding affinity to human IKBKAP incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 106.75 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: Inhibitor of nuclear factor kappa-B kinase subunit epsilon (SINGLE PROTEIN), Homo sapiens
UniProt: Q14164
Assay: Binding affinity to human IKBKE incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 5779.8 nM (pChEMBL 5.239999771118164)
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: Inhibitor of nuclear factor kappa-B kinase subunit epsilon (SINGLE PROTEIN), Homo sapiens
UniProt: Q14164
Assay: Binding affinity to human IKBKE incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 9309.84 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: Interleukin enhancer-binding factor 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q12905
Assay: Binding affinity to human ILF2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 13.47 nM (pChEMBL 7.869999885559082)
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: Interleukin enhancer-binding factor 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q12905
Assay: Binding affinity to human ILF2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 13.47 nM (pChEMBL 7.869999885559082)
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: Interleukin enhancer-binding factor 3 (SINGLE PROTEIN), Homo sapiens
UniProt: Q12906
Assay: Binding affinity to human ILF3 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 17.44 nM (pChEMBL 7.760000228881836)
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: Interleukin enhancer-binding factor 3 (SINGLE PROTEIN), Homo sapiens
UniProt: Q12906
Assay: Binding affinity to human ILF3 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 17.44 nM (pChEMBL 7.760000228881836)
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: Scaffold protein ILK (SINGLE PROTEIN), Homo sapiens
UniProt: Q13418
Assay: Binding affinity to human ILK incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 67272.95 nM (pChEMBL 4.170000076293945)
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: Scaffold protein ILK (SINGLE PROTEIN), Homo sapiens
UniProt: Q13418
Assay: Binding affinity to human ILK incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 67272.95 nM (pChEMBL 4.170000076293945)
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: 2-hydroxyacyl-CoA lyase 2 (SINGLE PROTEIN), Homo sapiens
UniProt: A1L0T0
Assay: Binding affinity to human ILVBL incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 10040.11 nM (pChEMBL 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: 2-hydroxyacyl-CoA lyase 2 (SINGLE PROTEIN), Homo sapiens
UniProt: A1L0T0
Assay: Binding affinity to human ILVBL incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 10040.11 nM (pChEMBL 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: MICOS complex subunit MIC60 (SINGLE PROTEIN), Homo sapiens
UniProt: Q16891
Assay: Binding affinity to human IMMT incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 7.429 nM (pChEMBL 8.130000114440918)
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: MICOS complex subunit MIC60 (SINGLE PROTEIN), Homo sapiens
UniProt: Q16891
Assay: Binding affinity to human IMMT incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 7.429 nM (pChEMBL 8.130000114440918)
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: Inositol monophosphatase 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P29218
Assay: Binding affinity to human IMPA1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 12055.5 nM (pChEMBL 4.920000076293945)
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: Inositol monophosphatase 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P29218
Assay: Binding affinity to human IMPA1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 12055.5 nM (pChEMBL 4.920000076293945)
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: Inosine-5'-monophosphate dehydrogenase 2 (SINGLE PROTEIN), Homo sapiens
UniProt: P12268
Assay: Binding affinity to human IMPDH2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 147.42 nM (pChEMBL 6.829999923706055)
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: Inosine-5'-monophosphate dehydrogenase 2 (SINGLE PROTEIN), Homo sapiens
UniProt: P12268
Assay: Binding affinity to human IMPDH2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 147.42 nM (pChEMBL 6.829999923706055)
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-internexin (SINGLE PROTEIN), Homo sapiens
UniProt: Q16352
Assay: Binding affinity to human INA incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 470.12 nM (pChEMBL 6.329999923706055)
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: Alpha-internexin (SINGLE PROTEIN), Homo sapiens
UniProt: Q16352
Assay: Binding affinity to human INA incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1702.28 nM (pChEMBL 5.769999980926514)
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: Inner centromere protein (SINGLE PROTEIN), Homo sapiens
UniProt: Q9NQS7
Assay: Binding affinity to human INCENP incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 204.47 nM (pChEMBL 6.690000057220459)
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: Inner centromere protein (SINGLE PROTEIN), Homo sapiens
UniProt: Q9NQS7
Assay: Binding affinity to human INCENP incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 229.09 nM (pChEMBL 6.639999866485596)
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: Inverted formin-2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q27J81
Assay: Binding affinity to human INF2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 114.64 nM (pChEMBL 6.940000057220459)
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: Inverted formin-2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q27J81
Assay: Binding affinity to human INF2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 114.64 nM (pChEMBL 6.940000057220459)
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: Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2 (SINGLE PROTEIN), Homo sapiens
UniProt: O15357
Assay: Binding affinity to human INPPL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 487.67 nM (pChEMBL 6.309999942779541)
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: Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2 (SINGLE PROTEIN), Homo sapiens
UniProt: O15357
Assay: Binding affinity to human INPPL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1008.81 nM (pChEMBL 6)
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: Insulin receptor (SINGLE PROTEIN), Homo sapiens
UniProt: P06213
Assay: Binding affinity to human INSR incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 6.481 nM (pChEMBL 8.1899995803833)
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: Insulin receptor (SINGLE PROTEIN), Homo sapiens
UniProt: P06213
Assay: Binding affinity to human INSR incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 8.632 nM (pChEMBL 8.0600004196167)
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: Importin-11 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UI26
Assay: Binding affinity to human IPO11 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 0.82 nM (pChEMBL 9.09000015258789)
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: Importin-11 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UI26
Assay: Binding affinity to human IPO11 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 0.82 nM (pChEMBL 9.09000015258789)
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: Importin-4 (SINGLE PROTEIN), Homo sapiens
UniProt: Q8TEX9
Assay: Binding affinity to human IPO4 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1812264.3 nM (pChEMBL 2.740000009536743)
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: Importin-5 (SINGLE PROTEIN), Homo sapiens
UniProt: O00410
Assay: Binding affinity to human IPO5 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 341.73 nM (pChEMBL 6.46999979019165)
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: Importin-5 (SINGLE PROTEIN), Homo sapiens
UniProt: O00410
Assay: Binding affinity to human IPO5 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 341.73 nM (pChEMBL 6.46999979019165)
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: Importin-7 (SINGLE PROTEIN), Homo sapiens
UniProt: O95373
Assay: Binding affinity to human IPO7 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 18.1 nM (pChEMBL 7.739999771118164)
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: Importin-7 (SINGLE PROTEIN), Homo sapiens
UniProt: O95373
Assay: Binding affinity to human IPO7 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 18.1 nM (pChEMBL 7.739999771118164)
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: Importin-8 (SINGLE PROTEIN), Homo sapiens
UniProt: O15397
Assay: Binding affinity to human IPO8 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 25817.37 nM (pChEMBL 4.590000152587891)
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: Importin-8 (SINGLE PROTEIN), Homo sapiens
UniProt: O15397
Assay: Binding affinity to human IPO8 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 25817.37 nM (pChEMBL 4.590000152587891)
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: Importin-9 (SINGLE PROTEIN), Homo sapiens
UniProt: Q96P70
Assay: Binding affinity to human IPO9 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 3.754 nM (pChEMBL 8.430000305175781)
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: Importin-9 (SINGLE PROTEIN), Homo sapiens
UniProt: Q96P70
Assay: Binding affinity to human IPO9 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 3.754 nM (pChEMBL 8.430000305175781)
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: Ras GTPase-activating-like protein IQGAP1 (SINGLE PROTEIN), Homo sapiens
UniProt: P46940
Assay: Binding affinity to human IQGAP1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 35.39 nM (pChEMBL 7.449999809265137)
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: Ras GTPase-activating-like protein IQGAP1 (SINGLE PROTEIN), Homo sapiens
UniProt: P46940
Assay: Binding affinity to human IQGAP1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 35.39 nM (pChEMBL 7.449999809265137)
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: Interleukin-1 receptor-associated kinase 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P51617
Assay: Binding affinity to human IRAK1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 29.26 nM (pChEMBL 7.53000020980835)
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: Interleukin-1 receptor-associated kinase 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P51617
Assay: Binding affinity to human IRAK1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 47.94 nM (pChEMBL 7.320000171661377)
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: Interleukin-1 receptor-associated kinase 3 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9Y616
Assay: Binding affinity to human IRAK3 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 11.24 nM (pChEMBL 7.949999809265137)
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: Interleukin-1 receptor-associated kinase 3 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9Y616
Assay: Binding affinity to human IRAK3 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 26.22 nM (pChEMBL 7.579999923706055)
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: Interleukin-1 receptor-associated kinase 4 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9NWZ3
Assay: Binding affinity to human IRAK4 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 646998.39 nM (pChEMBL 3.190000057220459)
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: Interferon regulatory factor 2-binding protein 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q7Z5L9
Assay: Binding affinity to human IRF2BP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 84.2 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: Interferon regulatory factor 2-binding protein 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q7Z5L9
Assay: Binding affinity to human IRF2BP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 84.2 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: E3 ubiquitin-protein ligase Itchy homolog (SINGLE PROTEIN), Homo sapiens
UniProt: Q96J02
Assay: Binding affinity to human ITCH incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 6516.84 nM (pChEMBL 5.190000057220459)
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 Itchy homolog (SINGLE PROTEIN), Homo sapiens
UniProt: Q96J02
Assay: Binding affinity to human ITCH incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 6516.84 nM (pChEMBL 5.190000057220459)
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: Lamin-B1 (SINGLE PROTEIN), Homo sapiens
UniProt: P20700
Assay: Binding affinity to human LMNB1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 420.06 nM (pChEMBL 6.380000114440918)
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: Lamin-B1 (SINGLE PROTEIN), Homo sapiens
UniProt: P20700
Assay: Binding affinity to human LMNB1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 420.06 nM (pChEMBL 6.380000114440918)
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: Prelamin-A/C (SINGLE PROTEIN), Homo sapiens
UniProt: P02545
Assay: Binding affinity to human LMNA incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 2397.71 nM (pChEMBL 5.619999885559082)
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: Prelamin-A/C (SINGLE PROTEIN), Homo sapiens
UniProt: P02545
Assay: Binding affinity to human LMNA incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 2397.71 nM (pChEMBL 5.619999885559082)
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: Integrin alpha-6 (SINGLE PROTEIN), Homo sapiens
UniProt: P23229
Assay: Binding affinity to human ITGA6 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 7061.8 nM (pChEMBL 5.150000095367432)
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: Integrin alpha-6 (SINGLE PROTEIN), Homo sapiens
UniProt: P23229
Assay: Binding affinity to human ITGA6 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 7186.36 nM (pChEMBL 5.139999866485596)
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: Integrin beta-1 (SINGLE PROTEIN), Homo sapiens
UniProt: P05556
Assay: Binding affinity to human ITGB1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 3236.98 nM (pChEMBL 5.489999771118164)
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: Integrin beta-1 (SINGLE PROTEIN), Homo sapiens
UniProt: P05556
Assay: Binding affinity to human ITGB1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 3425.65 nM (pChEMBL 5.460000038146973)
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: Integrin beta-2 (SINGLE PROTEIN), Homo sapiens
UniProt: P05107
Assay: Binding affinity to human ITGB2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 23.93 nM (pChEMBL 7.619999885559082)
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: Integrin beta-2 (SINGLE PROTEIN), Homo sapiens
UniProt: P05107
Assay: Binding affinity to human ITGB2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 23.93 nM (pChEMBL 7.619999885559082)
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: Integrin beta-4 (SINGLE PROTEIN), Homo sapiens
UniProt: P16144
Assay: Binding affinity to human ITGB4 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 824651.04 nM (pChEMBL 3.0799999237060547)
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: Integrin beta-6 (SINGLE PROTEIN), Homo sapiens
UniProt: P18564
Assay: Binding affinity to human ITGB6 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 2554.74 nM (pChEMBL 5.590000152587891)
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: Integrin beta-6 (SINGLE PROTEIN), Homo sapiens
UniProt: P18564
Assay: Binding affinity to human ITGB6 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 2554.74 nM (pChEMBL 5.590000152587891)
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: Inosine triphosphate pyrophosphatase (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BY32
Assay: Binding affinity to human ITPA incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 6.286 nM (pChEMBL 8.199999809265137)
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: Inosine triphosphate pyrophosphatase (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BY32
Assay: Binding affinity to human ITPA incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 7.166 nM (pChEMBL 8.140000343322754)
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: Tyrosine-protein kinase JAK1 (SINGLE PROTEIN), Homo sapiens
UniProt: P23458
Assay: Binding affinity to human JAK1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 27.88 nM (pChEMBL 7.550000190734863)
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: Tyrosine-protein kinase JAK1 (SINGLE PROTEIN), Homo sapiens
UniProt: P23458
Assay: Binding affinity to human JAK1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 74.84 nM (pChEMBL 7.130000114440918)
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: Junction plakoglobin (SINGLE PROTEIN), Homo sapiens
UniProt: P14923
Assay: Binding affinity to human JUP incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 12704.16 nM (pChEMBL 4.900000095367432)
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: Junction plakoglobin (SINGLE PROTEIN), Homo sapiens
UniProt: P14923
Assay: Binding affinity to human JUP incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 12704.16 nM (pChEMBL 4.900000095367432)
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: Lysine--tRNA ligase (SINGLE PROTEIN), Homo sapiens
UniProt: Q15046
Assay: Binding affinity to human KARS incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 1773.62 nM (pChEMBL 5.75)
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: Lysine--tRNA ligase (SINGLE PROTEIN), Homo sapiens
UniProt: Q15046
Assay: Binding affinity to human KARS incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1773.62 nM (pChEMBL 5.75)
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: Katanin p60 ATPase-containing subunit A-like 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q8IYT4
Assay: Binding affinity to human KATNAL2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 6.467 nM (pChEMBL 8.1899995803833)
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: Katanin p60 ATPase-containing subunit A-like 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q8IYT4
Assay: Binding affinity to human KATNAL2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 6.467 nM (pChEMBL 8.1899995803833)
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: ER lumen protein-retaining receptor 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P24390
Assay: Binding affinity to human KDELR1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 0.253 nM (pChEMBL 9.600000381469727)
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: ER lumen protein-retaining receptor 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P24390
Assay: Binding affinity to human KDELR1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 0.253 nM (pChEMBL 9.600000381469727)
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: ER lumen protein-retaining receptor 2 (SINGLE PROTEIN), Homo sapiens
UniProt: P33947
Assay: Binding affinity to human KDELR2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 51.05 nM (pChEMBL 7.289999961853027)
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: ER lumen protein-retaining receptor 2 (SINGLE PROTEIN), Homo sapiens
UniProt: P33947
Assay: Binding affinity to human KDELR2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 51.05 nM (pChEMBL 7.289999961853027)
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: KH domain-containing, RNA-binding, signal transduction-associated protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q07666
Assay: Binding affinity to human KHDRBS1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 9619.05 nM (pChEMBL 5.019999980926514)
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: KH domain-containing, RNA-binding, signal transduction-associated protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q07666
Assay: Binding affinity to human KHDRBS1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 9619.05 nM (pChEMBL 5.019999980926514)
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: Far upstream element-binding protein 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q92945
Assay: Binding affinity to human KHSRP incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 3928.5 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: Far upstream element-binding protein 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q92945
Assay: Binding affinity to human KHSRP incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 4026.91 nM (pChEMBL 5.389999866485596)
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: WASH complex subunit 5 (SINGLE PROTEIN), Homo sapiens
UniProt: Q12768
Assay: Binding affinity to human KIAA0196 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 3061.11 nM (pChEMBL 5.510000228881836)
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: WASH complex subunit 5 (SINGLE PROTEIN), Homo sapiens
UniProt: Q12768
Assay: Binding affinity to human KIAA0196 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 3061.11 nM (pChEMBL 5.510000228881836)
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: Kinesin-1 heavy chain (SINGLE PROTEIN), Homo sapiens
UniProt: P33176
Assay: Binding affinity to human KIF5B incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 18120.43 nM (pChEMBL 4.739999771118164)
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: Kinesin-1 heavy chain (SINGLE PROTEIN), Homo sapiens
UniProt: P33176
Assay: Binding affinity to human KIF5B incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 18120.43 nM (pChEMBL 4.739999771118164)
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: Kinesin-like protein KIFC1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BW19
Assay: Binding affinity to human KIFC1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 11479.92 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: Kinesin-like protein KIFC1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BW19
Assay: Binding affinity to human KIFC1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 11479.92 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: Kinetochore-associated protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P50748
Assay: Binding affinity to human KNTC1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 54.26 nM (pChEMBL 7.269999980926514)
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: Kinetochore-associated protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P50748
Assay: Binding affinity to human KNTC1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 54.26 nM (pChEMBL 7.269999980926514)
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: Importin subunit alpha-1 (SINGLE PROTEIN), Homo sapiens
UniProt: P52292
Assay: Binding affinity to human KPNA2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 5.663 nM (pChEMBL 8.25)
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: Importin subunit alpha-1 (SINGLE PROTEIN), Homo sapiens
UniProt: P52292
Assay: Binding affinity to human KPNA2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 5.663 nM (pChEMBL 8.25)
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: Importin subunit beta-1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q14974
Assay: Binding affinity to human KPNB1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 53.44 nM (pChEMBL 7.269999980926514)
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: Importin subunit beta-1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q14974
Assay: Binding affinity to human KPNB1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 53.44 nM (pChEMBL 7.269999980926514)
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: Keratin, type I cytoskeletal 18 (SINGLE PROTEIN), Homo sapiens
UniProt: P05783
Assay: Binding affinity to human KRT18 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 580.92 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: Keratin, type I cytoskeletal 18 (SINGLE PROTEIN), Homo sapiens
UniProt: P05783
Assay: Binding affinity to human KRT18 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 580.92 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: Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit KCP2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q8N6L1
Assay: Binding affinity to human KRTCAP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 7592.35 nM (pChEMBL 5.119999885559082)
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: Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit KCP2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q8N6L1
Assay: Binding affinity to human KRTCAP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 7592.35 nM (pChEMBL 5.119999885559082)
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: Kinectin (SINGLE PROTEIN), Homo sapiens
UniProt: Q86UP2
Assay: Binding affinity to human KTN1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 466.27 nM (pChEMBL 6.329999923706055)
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: Kinectin (SINGLE PROTEIN), Homo sapiens
UniProt: Q86UP2
Assay: Binding affinity to human KTN1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 466.27 nM (pChEMBL 6.329999923706055)
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: Neural cell adhesion molecule L1 (SINGLE PROTEIN), Homo sapiens
UniProt: P32004
Assay: Binding affinity to human L1CAM incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 26.18 nM (pChEMBL 7.579999923706055)
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: Neural cell adhesion molecule L1 (SINGLE PROTEIN), Homo sapiens
UniProt: P32004
Assay: Binding affinity to human L1CAM incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 40.78 nM (pChEMBL 7.389999866485596)
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: Lysosome-associated membrane glycoprotein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P11279
Assay: Binding affinity to human LAMP1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 31.64 nM (pChEMBL 7.5)
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: Lysosome-associated membrane glycoprotein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P11279
Assay: Binding affinity to human LAMP1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 31.7 nM (pChEMBL 7.5)
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: Lysosome-associated membrane glycoprotein 2 (SINGLE PROTEIN), Homo sapiens
UniProt: P13473
Assay: Binding affinity to human LAMP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 1718.38 nM (pChEMBL 5.760000228881836)
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: Lysosome-associated membrane glycoprotein 2 (SINGLE PROTEIN), Homo sapiens
UniProt: P13473
Assay: Binding affinity to human LAMP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1718.38 nM (pChEMBL 5.760000228881836)
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: Glutathione S-transferase LANCL1 (SINGLE PROTEIN), Homo sapiens
UniProt: O43813
Assay: Binding affinity to human LANCL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 53.19 nM (pChEMBL 7.269999980926514)
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: Glutathione S-transferase LANCL1 (SINGLE PROTEIN), Homo sapiens
UniProt: O43813
Assay: Binding affinity to human LANCL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 53.19 nM (pChEMBL 7.269999980926514)
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: La-related protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q6PKG0
Assay: Binding affinity to human LARP1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 1685.57 nM (pChEMBL 5.769999980926514)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32