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: Developmentally-regulated GTP-binding protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9Y295
Assay: Binding affinity to human DRG1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1472.19 nM (pChEMBL 5.829999923706055)
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: Desmoplakin (SINGLE PROTEIN), Homo sapiens
UniProt: P15924
Assay: Binding affinity to human DSP incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 287.71 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: Desmoplakin (SINGLE PROTEIN), Homo sapiens
UniProt: P15924
Assay: Binding affinity to human DSP incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 287.71 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: Destrin (SINGLE PROTEIN), Homo sapiens
UniProt: P60981
Assay: Binding affinity to human DSTN incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 1743.96 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: Destrin (SINGLE PROTEIN), Homo sapiens
UniProt: P60981
Assay: Binding affinity to human DSTN incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1743.96 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: D-aminoacyl-tRNA deacylase 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q8TEA8
Assay: Binding affinity to human DTD1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 20.18 nM (pChEMBL 7.699999809265137)
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: D-aminoacyl-tRNA deacylase 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q8TEA8
Assay: Binding affinity to human DTD1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 20.18 nM (pChEMBL 7.699999809265137)
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: Thymidylate kinase (SINGLE PROTEIN), Homo sapiens
UniProt: P23919
Assay: Binding affinity to human DTYMK incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 9926.24 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: Thymidylate kinase (SINGLE PROTEIN), Homo sapiens
UniProt: P23919
Assay: Binding affinity to human DTYMK incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 9926.24 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: Deoxyuridine 5'-triphosphate nucleotidohydrolase, mitochondrial (SINGLE PROTEIN), Homo sapiens
UniProt: P33316
Assay: Binding affinity to human DUT incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 37.07 nM (pChEMBL 7.429999828338623)
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: Deoxyuridine 5'-triphosphate nucleotidohydrolase, mitochondrial (SINGLE PROTEIN), Homo sapiens
UniProt: P33316
Assay: Binding affinity to human DUT incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 37.07 nM (pChEMBL 7.429999828338623)
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: Cytoplasmic dynein 1 heavy chain 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q14204
Assay: Binding affinity to human DYNC1H1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 51207009.43 nM (pChEMBL 1.2899999618530273)
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: Cytoplasmic dynein 1 intermediate chain 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q13409
Assay: Binding affinity to human DYNC1I2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 2.384 nM (pChEMBL 8.619999885559082)
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: Cytoplasmic dynein 1 intermediate chain 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q13409
Assay: Binding affinity to human DYNC1I2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 2.384 nM (pChEMBL 8.619999885559082)
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: Cytoplasmic dynein 1 light intermediate chain 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9Y6G9
Assay: Binding affinity to human DYNC1LI1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 896.86 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: Cytoplasmic dynein 1 light intermediate chain 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9Y6G9
Assay: Binding affinity to human DYNC1LI1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 896.86 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: Cytoplasmic dynein 1 light intermediate chain 2 (SINGLE PROTEIN), Homo sapiens
UniProt: O43237
Assay: Binding affinity to human DYNC1LI2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 27.83 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: Cytoplasmic dynein 1 light intermediate chain 2 (SINGLE PROTEIN), Homo sapiens
UniProt: O43237
Assay: Binding affinity to human DYNC1LI2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 27.83 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: Dynein light chain 1, cytoplasmic (SINGLE PROTEIN), Homo sapiens
UniProt: P63167
Assay: Binding affinity to human DYNLL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 2583.86 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: Dynein light chain 1, cytoplasmic (SINGLE PROTEIN), Homo sapiens
UniProt: P63167
Assay: Binding affinity to human DYNLL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 5158 nM (pChEMBL 5.289999961853027)
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: Dynein light chain 2, cytoplasmic (SINGLE PROTEIN), Homo sapiens
UniProt: Q96FJ2
Assay: Binding affinity to human DYNLL2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 250.53 nM (pChEMBL 6.599999904632568)
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: Dynein light chain 2, cytoplasmic (SINGLE PROTEIN), Homo sapiens
UniProt: Q96FJ2
Assay: Binding affinity to human DYNLL2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 458.5 nM (pChEMBL 6.340000152587891)
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 tyrosine-phosphorylation-regulated kinase 1A (SINGLE PROTEIN), Homo sapiens
UniProt: Q13627
Assay: Binding affinity to human DYRK1A incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 11671.91 nM (pChEMBL 4.929999828338623)
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: Dual specificity tyrosine-phosphorylation-regulated kinase 1A (SINGLE PROTEIN), Homo sapiens
UniProt: Q13627
Assay: Binding affinity to human DYRK1A incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 12509.99 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: Probable rRNA-processing protein EBP2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q99848
Assay: Binding affinity to human EBNA1BP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 43.16 nM (pChEMBL 7.369999885559082)
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: Probable rRNA-processing protein EBP2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q99848
Assay: Binding affinity to human EBNA1BP2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 43.16 nM (pChEMBL 7.369999885559082)
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: 3-beta-hydroxysteroid-Delta(8),Delta(7)-isomerase (SINGLE PROTEIN), Homo sapiens
UniProt: Q15125
Assay: Binding affinity to human EBP incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 12.28 nM (pChEMBL 7.909999847412109)
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: 3-beta-hydroxysteroid-Delta(8),Delta(7)-isomerase (SINGLE PROTEIN), Homo sapiens
UniProt: Q15125
Assay: Binding affinity to human EBP incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 12.28 nM (pChEMBL 7.909999847412109)
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: Delta(3,5)-Delta(2,4)-dienoyl-CoA isomerase, mitochondrial (SINGLE PROTEIN), Homo sapiens
UniProt: Q13011
Assay: Binding affinity to human ECH1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 40.04 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: Delta(3,5)-Delta(2,4)-dienoyl-CoA isomerase, mitochondrial (SINGLE PROTEIN), Homo sapiens
UniProt: Q13011
Assay: Binding affinity to human ECH1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 40.04 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: Enoyl-CoA hydratase, mitochondrial (SINGLE PROTEIN), Homo sapiens
UniProt: P30084
Assay: Binding affinity to human ECHS1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 180.79 nM (pChEMBL 6.739999771118164)
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: Enoyl-CoA hydratase, mitochondrial (SINGLE PROTEIN), Homo sapiens
UniProt: P30084
Assay: Binding affinity to human ECHS1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 180.79 nM (pChEMBL 6.739999771118164)
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: Enoyl-CoA delta isomerase 1, mitochondrial (SINGLE PROTEIN), Homo sapiens
UniProt: P42126
Assay: Binding affinity to human ECI1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 63980.13 nM (pChEMBL 4.190000057220459)
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: Enoyl-CoA delta isomerase 1, mitochondrial (SINGLE PROTEIN), Homo sapiens
UniProt: P42126
Assay: Binding affinity to human ECI1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 63980.13 nM (pChEMBL 4.190000057220459)
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: Proteasome adapter and scaffold protein ECM29 (SINGLE PROTEIN), Homo sapiens
UniProt: Q5VYK3
Assay: Binding affinity to human ECM29 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 1150.55 nM (pChEMBL 5.940000057220459)
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: Proteasome adapter and scaffold protein ECM29 (SINGLE PROTEIN), Homo sapiens
UniProt: Q5VYK3
Assay: Binding affinity to human ECM29 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1150.55 nM (pChEMBL 5.940000057220459)
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: Endothelial differentiation-related factor 1 (SINGLE PROTEIN), Homo sapiens
UniProt: O60869
Assay: Binding affinity to human EDF1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 1433.34 nM (pChEMBL 5.840000152587891)
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: Endothelial differentiation-related factor 1 (SINGLE PROTEIN), Homo sapiens
UniProt: O60869
Assay: Binding affinity to human EDF1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1433.34 nM (pChEMBL 5.840000152587891)
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: Early endosome antigen 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q15075
Assay: Binding affinity to human EEA1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 25461.53 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: Early endosome antigen 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q15075
Assay: Binding affinity to human EEA1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 25461.53 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: Elongation factor 1-delta (SINGLE PROTEIN), Homo sapiens
UniProt: P29692
Assay: Binding affinity to human EEF1D incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 53.79 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: Elongation factor 1-delta (SINGLE PROTEIN), Homo sapiens
UniProt: P29692
Assay: Binding affinity to human EEF1D incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 53.79 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: Eukaryotic translation elongation factor 1 epsilon-1 (SINGLE PROTEIN), Homo sapiens
UniProt: O43324
Assay: Binding affinity to human EEF1E1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 501.53 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: Eukaryotic translation elongation factor 1 epsilon-1 (SINGLE PROTEIN), Homo sapiens
UniProt: O43324
Assay: Binding affinity to human EEF1E1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 501.53 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: Elongation factor 1-gamma (SINGLE PROTEIN), Homo sapiens
UniProt: P26641
Assay: Binding affinity to human EEF1G incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 0.491 nM (pChEMBL 9.3100004196167)
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 1-gamma (SINGLE PROTEIN), Homo sapiens
UniProt: P26641
Assay: Binding affinity to human EEF1G incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 0.491 nM (pChEMBL 9.3100004196167)
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 2 (SINGLE PROTEIN), Homo sapiens
UniProt: P13639
Assay: Binding affinity to human EEF2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 12527.69 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: Elongation factor 2 (SINGLE PROTEIN), Homo sapiens
UniProt: P13639
Assay: Binding affinity to human EEF2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 12527.69 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: EF-hand domain-containing protein D2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q96C19
Assay: Binding affinity to human EFHD2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 15.51 nM (pChEMBL 7.809999942779541)
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: EF-hand domain-containing protein D2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q96C19
Assay: Binding affinity to human EFHD2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 20.8 nM (pChEMBL 7.679999828338623)
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: 116 kDa U5 small nuclear ribonucleoprotein component (SINGLE PROTEIN), Homo sapiens
UniProt: Q15029
Assay: Binding affinity to human EFTUD2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 59.32 nM (pChEMBL 7.230000019073486)
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: 116 kDa U5 small nuclear ribonucleoprotein component (SINGLE PROTEIN), Homo sapiens
UniProt: Q15029
Assay: Binding affinity to human EFTUD2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 59.32 nM (pChEMBL 7.230000019073486)
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: Epidermal growth factor receptor (SINGLE PROTEIN), Homo sapiens
UniProt: P00533
Assay: Binding affinity to human EGFR incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 168.68 nM (pChEMBL 6.769999980926514)
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: Epidermal growth factor receptor (SINGLE PROTEIN), Homo sapiens
UniProt: P00533
Assay: Binding affinity to human EGFR incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 212.69 nM (pChEMBL 6.670000076293945)
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: Etoposide-induced protein 2.4 homolog (SINGLE PROTEIN), Homo sapiens
UniProt: O14681
Assay: Binding affinity to human EI24 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 190.86 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: Etoposide-induced protein 2.4 homolog (SINGLE PROTEIN), Homo sapiens
UniProt: O14681
Assay: Binding affinity to human EI24 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 190.86 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: Eukaryotic translation initiation factor 2A (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BY44
Assay: Binding affinity to human EIF2A incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 35.1 nM (pChEMBL 7.460000038146973)
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: Eukaryotic translation initiation factor 2A (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BY44
Assay: Binding affinity to human EIF2A incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 38.65 nM (pChEMBL 7.409999847412109)
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: Translation initiation factor eIF2B subunit alpha (SINGLE PROTEIN), Homo sapiens
UniProt: Q14232
Assay: Binding affinity to human EIF2B1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 28853.46 nM (pChEMBL 4.539999961853027)
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: Translation initiation factor eIF2B subunit alpha (SINGLE PROTEIN), Homo sapiens
UniProt: Q14232
Assay: Binding affinity to human EIF2B1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 28853.46 nM (pChEMBL 4.539999961853027)
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: Translation initiation factor eIF2B subunit beta (SINGLE PROTEIN), Homo sapiens
UniProt: P49770
Assay: Binding affinity to human EIF2B2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 10.87 nM (pChEMBL 7.960000038146973)
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: Translation initiation factor eIF2B subunit beta (SINGLE PROTEIN), Homo sapiens
UniProt: P49770
Assay: Binding affinity to human EIF2B2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 10.87 nM (pChEMBL 7.960000038146973)
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: Translation initiation factor eIF2B subunit gamma (SINGLE PROTEIN), Homo sapiens
UniProt: Q9NR50
Assay: Binding affinity to human EIF2B3 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 330.16 nM (pChEMBL 6.480000019073486)
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: Translation initiation factor eIF2B subunit gamma (SINGLE PROTEIN), Homo sapiens
UniProt: Q9NR50
Assay: Binding affinity to human EIF2B3 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 332.42 nM (pChEMBL 6.480000019073486)
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: Translation initiation factor eIF2B subunit delta (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UI10
Assay: Binding affinity to human EIF2B4 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 308.3 nM (pChEMBL 6.510000228881836)
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: Translation initiation factor eIF2B subunit delta (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UI10
Assay: Binding affinity to human EIF2B4 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 308.3 nM (pChEMBL 6.510000228881836)
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: Eukaryotic translation initiation factor 2 subunit 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P05198
Assay: Binding affinity to human EIF2S1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 77.87 nM (pChEMBL 7.110000133514404)
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: Eukaryotic translation initiation factor 2 subunit 1 (SINGLE PROTEIN), Homo sapiens
UniProt: P05198
Assay: Binding affinity to human EIF2S1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 77.87 nM (pChEMBL 7.110000133514404)
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: Eukaryotic translation initiation factor 2 subunit 2 (SINGLE PROTEIN), Homo sapiens
UniProt: P20042
Assay: Binding affinity to human EIF2S2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 7970.31 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: Eukaryotic translation initiation factor 2 subunit 2 (SINGLE PROTEIN), Homo sapiens
UniProt: P20042
Assay: Binding affinity to human EIF2S2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 7970.31 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: Eukaryotic initiation factor 4A-I (SINGLE PROTEIN), Homo sapiens
UniProt: P60842
Assay: Binding affinity to human EIF4A1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 58065.51 nM (pChEMBL 4.239999771118164)
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: Eukaryotic initiation factor 4A-I (SINGLE PROTEIN), Homo sapiens
UniProt: P60842
Assay: Binding affinity to human EIF4A1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 58065.51 nM (pChEMBL 4.239999771118164)
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: Eukaryotic initiation factor 4A-III (SINGLE PROTEIN), Homo sapiens
UniProt: P38919
Assay: Binding affinity to human EIF4A3 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 73.93 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: Eukaryotic initiation factor 4A-III (SINGLE PROTEIN), Homo sapiens
UniProt: P38919
Assay: Binding affinity to human EIF4A3 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 73.93 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: Eukaryotic translation initiation factor 4B (SINGLE PROTEIN), Homo sapiens
UniProt: P23588
Assay: Binding affinity to human EIF4B incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 0.1 nM (pChEMBL 10)
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: Eukaryotic translation initiation factor 4B (SINGLE PROTEIN), Homo sapiens
UniProt: P23588
Assay: Binding affinity to human EIF4B incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 0.1 nM (pChEMBL 10)
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: Eukaryotic translation initiation factor 4E (SINGLE PROTEIN), Homo sapiens
UniProt: P06730
Assay: Binding affinity to human EIF4E incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 388.22 nM (pChEMBL 6.409999847412109)
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: Eukaryotic translation initiation factor 4E (SINGLE PROTEIN), Homo sapiens
UniProt: P06730
Assay: Binding affinity to human EIF4E incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 388.22 nM (pChEMBL 6.409999847412109)
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: Eukaryotic translation initiation factor 4 gamma 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q04637
Assay: Binding affinity to human EIF4G1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 77.79 nM (pChEMBL 7.110000133514404)
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: Eukaryotic translation initiation factor 4 gamma 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q04637
Assay: Binding affinity to human EIF4G1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 77.79 nM (pChEMBL 7.110000133514404)
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: Eukaryotic translation initiation factor 4 gamma 2 (SINGLE PROTEIN), Homo sapiens
UniProt: P78344
Assay: Binding affinity to human EIF4G2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 85679.53 nM (pChEMBL 4.070000171661377)
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: Eukaryotic translation initiation factor 4 gamma 2 (SINGLE PROTEIN), Homo sapiens
UniProt: P78344
Assay: Binding affinity to human EIF4G2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 85679.53 nM (pChEMBL 4.070000171661377)
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: Eukaryotic translation initiation factor 4H (SINGLE PROTEIN), Homo sapiens
UniProt: Q15056
Assay: Binding affinity to human EIF4H incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 10796.08 nM (pChEMBL 4.96999979019165)
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: Eukaryotic translation initiation factor 4H (SINGLE PROTEIN), Homo sapiens
UniProt: Q15056
Assay: Binding affinity to human EIF4H incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 10796.08 nM (pChEMBL 4.96999979019165)
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: Eukaryotic translation initiation factor 5B (SINGLE PROTEIN), Homo sapiens
UniProt: O60841
Assay: Binding affinity to human EIF5B incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 383437.41 nM (pChEMBL 3.4200000762939453)
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: Eukaryotic translation initiation factor 6 (SINGLE PROTEIN), Homo sapiens
UniProt: P56537
Assay: Binding affinity to human EIF6 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 222.93 nM (pChEMBL 6.650000095367432)
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: Eukaryotic translation initiation factor 6 (SINGLE PROTEIN), Homo sapiens
UniProt: P56537
Assay: Binding affinity to human EIF6 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 222.93 nM (pChEMBL 6.650000095367432)
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: ELAV-like protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q15717
Assay: Binding affinity to human ELAVL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 16511.76 nM (pChEMBL 4.78000020980835)
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: ELAV-like protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q15717
Assay: Binding affinity to human ELAVL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 16511.76 nM (pChEMBL 4.78000020980835)
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: Very long chain fatty acid elongase 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BW60
Assay: Binding affinity to human ELOVL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 309.57 nM (pChEMBL 6.510000228881836)
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: Very long chain fatty acid elongase 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9BW60
Assay: Binding affinity to human ELOVL1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 309.57 nM (pChEMBL 6.510000228881836)
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: ER membrane protein complex subunit 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q15006
Assay: Binding affinity to human EMC2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 331.07 nM (pChEMBL 6.480000019073486)
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: ER membrane protein complex subunit 2 (SINGLE PROTEIN), Homo sapiens
UniProt: Q15006
Assay: Binding affinity to human EMC2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 331.07 nM (pChEMBL 6.480000019073486)
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: ER membrane protein complex subunit 3 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9P0I2
Assay: Binding affinity to human EMC3 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 10.02 nM (pChEMBL 8)
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 membrane protein complex subunit 3 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9P0I2
Assay: Binding affinity to human EMC3 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 10.02 nM (pChEMBL 8)
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: Emerin (SINGLE PROTEIN), Homo sapiens
UniProt: P50402
Assay: Binding affinity to human EMD incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 501.12 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: Emerin (SINGLE PROTEIN), Homo sapiens
UniProt: P50402
Assay: Binding affinity to human EMD incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 501.12 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: Endonuclease domain-containing 1 protein (SINGLE PROTEIN), Homo sapiens
UniProt: O94919
Assay: Binding affinity to human ENDOD1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 246.15 nM (pChEMBL 6.610000133514404)
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: Endonuclease domain-containing 1 protein (SINGLE PROTEIN), Homo sapiens
UniProt: O94919
Assay: Binding affinity to human ENDOD1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 249.01 nM (pChEMBL 6.599999904632568)
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-enolase (SINGLE PROTEIN), Homo sapiens
UniProt: P06733
Assay: Binding affinity to human ENO1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 52.99 nM (pChEMBL 7.28000020980835)
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: Alpha-enolase (SINGLE PROTEIN), Homo sapiens
UniProt: P06733
Assay: Binding affinity to human ENO1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 52.99 nM (pChEMBL 7.28000020980835)
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: Protein 4.1 (SINGLE PROTEIN), Homo sapiens
UniProt: P11171
Assay: Binding affinity to human EPB41 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 7.837 nM (pChEMBL 8.109999656677246)
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 4.1 (SINGLE PROTEIN), Homo sapiens
UniProt: P11171
Assay: Binding affinity to human EPB41 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 7.837 nM (pChEMBL 8.109999656677246)
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: Band 4.1-like protein 2 (SINGLE PROTEIN), Homo sapiens
UniProt: O43491
Assay: Binding affinity to human EPB41L2 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 337.96 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: Band 4.1-like protein 2 (SINGLE PROTEIN), Homo sapiens
UniProt: O43491
Assay: Binding affinity to human EPB41L2 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 337.96 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: Epithelial cell adhesion molecule (SINGLE PROTEIN), Homo sapiens
UniProt: P16422
Assay: Binding affinity to human EPCAM incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 0.472 nM (pChEMBL 9.329999923706055)
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: Epithelial cell adhesion molecule (SINGLE PROTEIN), Homo sapiens
UniProt: P16422
Assay: Binding affinity to human EPCAM incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 0.472 nM (pChEMBL 9.329999923706055)
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: Mammalian ependymin-related protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UM22
Assay: Binding affinity to human EPDR1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 11.49 nM (pChEMBL 7.940000057220459)
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: Mammalian ependymin-related protein 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9UM22
Assay: Binding affinity to human EPDR1 incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 16 nM (pChEMBL 7.800000190734863)
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: Bifunctional glutamate/proline--tRNA ligase (SINGLE PROTEIN), Homo sapiens
UniProt: P07814
Assay: Binding affinity to human EPRS incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 1214.66 nM (pChEMBL 5.920000076293945)
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: Bifunctional glutamate/proline--tRNA ligase (SINGLE PROTEIN), Homo sapiens
UniProt: P07814
Assay: Binding affinity to human EPRS incubated for 45 mins by Kinobead based pull down assay
Measurement: ED50 = 1214.66 nM (pChEMBL 5.920000076293945)
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: Ethanolaminephosphotransferase 1 (SINGLE PROTEIN), Homo sapiens
UniProt: Q9C0D9
Assay: Binding affinity to human EPT1 incubated for 45 mins by Kinobead based pull down assay
Measurement: Kd = 809.16 nM (pChEMBL 6.090000152587891)
Descriptors: MW 503.49, ALogP 5.75, HBA 7, HBD 2, PSA 97.62, QED 0.32