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P36897 | TGFR1_HUMAN | TGF-beta receptor type-1 (TGFBR1)

3D structures mapped by conservation among orthologs

[ Domain: "Protein kinase" // Pkinase_Tyr ]

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[ Domain: "Snake toxin-like" // Activin_recp ]

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[ Domain: pdbs with more than 2 multi-domains ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL4855730 OBDepict F NH S N O O H 2 N O HN IC50 = -20500.0 nM 452.51 Nc1ncc(-c2ccc(NS(=O)(=O)C3CC3)cc2F)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804709 cell-based format
CHEMBL4852453 OBDepict CH 3 N H 3 C N N N HN N H 3 C IC50 = 0.32 nM 448.57 Cc1ccccc1-c1cc(Nc2ccnc3cc(-c4cnn(CCN(C)C)c4)ccc23)ccn1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL519948 OBDepict H 3 C N N S NH 2 N N Ki = 0.33 nM 319.39 Cc1cccc(-c2nc(N)sc2-c2ccc3nccnc3c2)n1 Homo sapiens CHEMBL985076 single protein format
CHEMBL4858177 OBDepict H 3 C N CH 3 N N N NH N CH 3 IC50 = 0.34 nM 448.57 Cc1cccc(-c2cc(Nc3ccnc4cc(-c5cnn(CCN(C)C)c5)ccc34)ccn2)c1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4877947 OBDepict CH 3 N H 3 C N N N NH N IC50 = 0.35 nM 434.55 CN(C)CCn1cc(-c2ccc3c(Nc4ccnc(-c5ccccc5)c4)ccnc3c2)cn1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4846578 OBDepict CH 3 N H 3 C N N N NH N O IC50 = 0.51 nM 424.51 CN(C)CCn1cc(-c2ccc3c(Nc4ccnc(-c5ccoc5)c4)ccnc3c2)cn1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4872884 OBDepict CH 3 S O O N HN N O IC50 = 0.54 nM 441.51 CS(=O)(=O)c1ccc(-c2ccc3c(Nc4ccnc(-c5ccoc5)c4)ccnc3c2)cc1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4217699 OBDepict F N NH N N N N H F F F IC50 = 0.55 nM 374.3 Fc1cnccc1Nc1nc(-c2cccc(C(F)(F)F)n2)nc2[nH]ccc12 Homo sapiens CHEMBL4188411 cell-based format
CHEMBL1835530 OBDepict CH 3 O N H N S N N N CH 3 N N IC50 = 0.57 nM 441.52 COc1ccc(NC(=S)n2cc(-c3ccc4ncnn4c3)c(-c3cccc(C)n3)n2)cc1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL4861887 OBDepict F F N N H N S O O CH 3 IC50 = 0.62 nM 487.53 CS(=O)(=O)c1ccc(-c2ccc3c(Nc4ccnc(-c5cc(F)ccc5F)c4)ccnc3c2)cc1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4872045 OBDepict CH 3 N H 3 C N N N NH N F IC50 = 0.63 nM 452.54 CN(C)CCn1cc(-c2ccc3c(Nc4ccnc(-c5cccc(F)c5)c4)ccnc3c2)cn1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4874893 OBDepict H 3 C N NH N S O O CH 3 IC50 = 0.65 nM 465.58 Cc1ccccc1-c1cc(Nc2ccnc3cc(-c4ccc(S(C)(=O)=O)cc4)ccc23)ccn1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4867170 OBDepict F N N H N S O O CH 3 IC50 = 0.67 nM 469.54 CS(=O)(=O)c1ccc(-c2ccc3c(Nc4ccnc(-c5ccccc5F)c4)ccnc3c2)cc1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4455462 OBDepict F F N N N N N CH 3 O H 2 N IC50 = 0.7 nM 382.37 Cc1cccc(-c2ncn(CC(F)F)c2-c2ccc3ncc(C(N)=O)n3c2)n1 Homo sapiens CHEMBL4339037 single protein format
CHEMBL480742 OBDepict H N NH 2 N N N N CH 3 F Ki = 0.7 nM 320.33 Cc1nc(-c2nc(N)[nH]c2-c2ccc3nccnc3c2)ccc1F Homo sapiens CHEMBL985076 single protein format
CHEMBL4851363 OBDepict CH 3 N N H N S O O CH 3 IC50 = 0.79 nM 465.58 Cc1cccc(-c2cc(Nc3ccnc4cc(-c5ccc(S(C)(=O)=O)cc5)ccc34)ccn2)c1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4863867 OBDepict H 3 C N CH 3 N N N HN N F IC50 = 0.82 nM 452.54 CN(C)CCn1cc(-c2ccc3c(Nc4ccnc(-c5ccccc5F)c4)ccnc3c2)cn1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4877481 OBDepict CH 3 S O O N N H N IC50 = 0.88 nM 451.55 CS(=O)(=O)c1ccc(-c2ccc3c(Nc4ccnc(-c5ccccc5)c4)ccnc3c2)cc1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4440988 OBDepict F F N N N N N O H 2 N F IC50 = 0.9 nM 386.34 NC(=O)c1cnc2ccc(-c3c(-c4ccc(F)cc4)ncn3CC(F)F)nn12 Homo sapiens CHEMBL4339037 single protein format
CHEMBL4205457 OBDepict CH 3 N N N N HN F N IC50 = 0.96 nM 320.33 Cc1cccc(-c2nc(Nc3ccncc3F)c3cccn3n2)n1 Homo sapiens CHEMBL4188411 cell-based format
CHEMBL2024689 OBDepict H 3 C N N N CH 3 N O N CH 3 IC50 = 1.0 nM 345.41 CCc1cc(-c2ccc3ncn(C)c(=O)c3c2)n(-c2cccc(C)n2)n1 Homo sapiens CHEMBL2026330 single protein format
CHEMBL4458215 OBDepict F F N N N N N CH 3 IC50 = 1.0 nM 339.35 Cc1cccc(-c2ncn(CC(F)F)c2-c2ccc3nccn3c2)n1 Homo sapiens CHEMBL4339037 single protein format
CHEMBL1272128 OBDepict CH 3 N H O N H O NH N S O O H 3 C N CH 3 H 3 C IC50 = 1.0 nM 547.68 CCNC(=O)c1ccc2c(c1)NC(=O)/C2=C(Nc1ccc(N(CCN(C)C)S(C)(=O)=O)cc1)c1ccccc1 Homo sapiens CHEMBL1272395 single protein format
CHEMBL2024688 OBDepict H 3 C N N N H 3 C N O N H IC50 = 1.0 nM 317.35 Cc1cccc(-n2ncc(C)c2-c2ccc3nc[nH]c(=O)c3c2)n1 Homo sapiens CHEMBL2026330 single protein format
CHEMBL4850787 OBDepict CH 3 N H 3 C N N N NH N F F IC50 = 1.03 nM 470.53 CN(C)CCn1cc(-c2ccc3c(Nc4ccnc(-c5cc(F)ccc5F)c4)ccnc3c2)cn1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL3260904 OBDepict N NH N CH 3 CH 3 N N H N N N H 3 C N IC50 = 1.3 nM 449.52 Cc1cccc(-c2[nH]c(CNc3cc(C#N)ccc3N(C)C)nc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL3268788 cell-based format
CHEMBL4206793 OBDepict H 3 C N N N N N H N IC50 = 1.3 nM 302.34 Cc1cccc(-c2nc(Nc3ccncc3)c3cccn3n2)n1 Homo sapiens CHEMBL4188411 cell-based format
CHEMBL4874538 OBDepict F N N H N S O O CH 3 IC50 = 1.37 nM 469.54 CS(=O)(=O)c1ccc(-c2ccc3c(Nc4ccnc(-c5cccc(F)c5)c4)ccnc3c2)cc1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4875547 OBDepict CH 3 N H 3 C N N N NH N S IC50 = 1.53 nM 440.58 CN(C)CCn1cc(-c2ccc3c(Nc4ccnc(-c5ccsc5)c4)ccnc3c2)cn1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4205979 OBDepict H 3 C N N N N NH N IC50 = 1.6 nM 352.4 Cc1cccc(-c2nc(Nc3ccnc4ccccc34)c3cccn3n2)n1 Homo sapiens CHEMBL4188411 cell-based format
CHEMBL4514379 OBDepict OH N N N N N Cl N F IC50 = 1.6 nM 382.79 N#Cc1cnc2ccc(-c3c(-c4ccc(F)c(Cl)c4)ncn3CCO)nn12 Homo sapiens CHEMBL4339037 single protein format
CHEMBL4584495 OBDepict N N N N N N F F F IC50 = 1.6 nM 368.32 N#Cc1cnc2ccc(-c3c(-c4ccc(F)cc4)ncn3CC(F)F)nn12 Homo sapiens CHEMBL4339037 single protein format
CHEMBL4847382 OBDepict CH 3 N H 3 C N N N HN N CH 3 IC50 = 1.65 nM 448.57 Cc1ccc(-c2cc(Nc3ccnc4cc(-c5cnn(CCN(C)C)c5)ccc34)ccn2)cc1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4204772 OBDepict F N N H N N N N IC50 = 1.7 nM 306.3 Fc1cnccc1Nc1nc(-c2ccccn2)nn2cccc12 Homo sapiens CHEMBL4188411 cell-based format
CHEMBL3818173 OBDepict O N H N NH Cl O N O IC50 = 1.9 nM 332.75 O=C(Nc1cc(Nc2c(Cl)cnc3c2OCO3)ccn1)C1CC1 Homo sapiens CHEMBL3820167 assay format
CHEMBL4853591 OBDepict F N N H N S O O CH 3 IC50 = 1.9 nM 469.54 CS(=O)(=O)c1ccc(-c2ccc3c(Nc4ccnc(-c5ccc(F)cc5)c4)ccnc3c2)cc1 Homo sapiens CHEMBL4844300 cell-based format
CHEMBL4280660 OBDepict H 3 C NH O N N H N N Cl IC50 = 2.0 nM 363.81 CC(=O)Nc1cc(-c2[nH]c3cccnc3c2-c2ccc(Cl)cn2)ccn1 Homo sapiens CHEMBL4270414 single protein format
CHEMBL2024691 OBDepict CH 3 N N N N O N H 3 C H IC50 = 2.0 nM 331.38 CCc1cnn(-c2cccc(C)n2)c1-c1ccc2nc[nH]c(=O)c2c1 Homo sapiens CHEMBL2026330 single protein format
CHEMBL4292047 OBDepict CH 3 HN O N N H N N H 3 C IC50 = 2.0 nM 343.39 CC(=O)Nc1cc(-c2[nH]c3cccnc3c2-c2cccc(C)n2)ccn1 Homo sapiens CHEMBL4270414 single protein format
CHEMBL4276907 OBDepict CH 3 HN O N N H N N F F F IC50 = 2.0 nM 397.36 CC(=O)Nc1cc(-c2[nH]c3cccnc3c2-c2cccc(C(F)(F)F)n2)ccn1 Homo sapiens CHEMBL4270414 single protein format
CHEMBL517068 OBDepict CH 3 N H O N N H N N H 3 C N F N Ki = 2.07 nM 351.35 CC(=O)Nc1nc(-c2ccc(F)c(C)n2)c(-c2ccc3ncnn3c2)[nH]1 Homo sapiens CHEMBL985076 single protein format
CHEMBL4214237 OBDepict OH N N N H O N N H N N N N F F F IC50 = 2.1 nM 541.54 O=C(CN1CCN(CCO)CC1)Nc1cc(Nc2nc(-c3cccc(C(F)(F)F)n3)nn3cccc23)ccn1 Homo sapiens CHEMBL4188411 cell-based format
CHEMBL1835622 OBDepict H 3 C N N N N H S N N N F F IC50 = 2.12 nM 447.47 Cc1cccc(-c2nn(C(=S)Nc3ccc(F)c(F)c3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL1835522 OBDepict CH 3 O N H N S N N N N CH 3 N IC50 = 2.26 nM 441.52 COc1cccc(NC(=S)n2cc(-c3ccc4ncnn4c3)c(-c3cccc(C)n3)n2)c1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL1835519 OBDepict H 3 C N N N N H S N N N Cl IC50 = 2.37 nM 445.94 Cc1cccc(-c2nn(C(=S)Nc3cccc(Cl)c3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL3260897 OBDepict N N NH CH 3 H 3 C N N H N N N H 3 C N IC50 = 2.4 nM 463.55 Cc1cccc(-c2[nH]c(CNc3cccc(C#N)c3CN(C)C)nc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL3268788 cell-based format
CHEMBL1835630 OBDepict CH 3 O N H O CH 3 N S N N N CH 3 N N IC50 = 2.49 nM 471.55 COc1cc(NC(=S)n2cc(-c3ccc4ncnn4c3)c(-c3cccc(C)n3)n2)cc(OC)c1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL4205311 OBDepict N N H N N N N IC50 = 2.5 nM 288.31 c1ccc(-c2nc(Nc3ccncc3)c3cccn3n2)nc1 Homo sapiens CHEMBL4188411 cell-based format
CHEMBL3260900 OBDepict N HN N CH 3 H 3 C N N H N N N CH 3 N IC50 = 2.6 nM 449.52 Cc1cccc(-c2[nH]c(CNc3cc(C#N)cc(N(C)C)c3)nc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL3268788 cell-based format
CHEMBL1835112 OBDepict H 3 C N N N N H S N N N IC50 = 2.82 nM 411.49 Cc1cccc(-c2nn(C(=S)Nc3ccccc3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL1835535 OBDepict H 3 C N N N N H S N N N Cl IC50 = 2.83 nM 445.94 Cc1cccc(-c2nn(C(=S)Nc3ccccc3Cl)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL3260627 OBDepict H 3 C N N H N N H N N N F N CH 3 H 3 C IC50 = 2.9 nM 442.5 Cc1cccc(-c2[nH]c(CNc3cc(N(C)C)ccc3F)nc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL3268788 cell-based format
CHEMBL450161 OBDepict CH 3 N H O N N H N N H 3 C N N Ki = 2.95 nM 333.36 CC(=O)Nc1nc(-c2cccc(C)n2)c(-c2ccc3ncnn3c2)[nH]1 Homo sapiens CHEMBL985076 single protein format
CHEMBL1835532 OBDepict N N H N S N N N H 3 C N N IC50 = 2.95 nM 436.5 Cc1cccc(-c2nn(C(=S)Nc3ccc(C#N)cc3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL480583 OBDepict H 3 C N F N N N H N N N N S O O CH 3 Ki = 3.0 nM 456.51 Cc1nc(-c2nc(N3CCN(S(C)(=O)=O)CC3)[nH]c2-c2ccc3ncnn3c2)ccc1F Homo sapiens CHEMBL985076 single protein format
CHEMBL4291307 OBDepict H 3 C NH O N N H N N F IC50 = 3.0 nM 347.35 CC(=O)Nc1cc(-c2[nH]c3cccnc3c2-c2ccc(F)cn2)ccn1 Homo sapiens CHEMBL4270414 single protein format
CHEMBL4279160 OBDepict CH 3 O N N N H N N H O CH 3 IC50 = 3.0 nM 359.39 COc1ccc(-c2c(-c3ccnc(NC(C)=O)c3)[nH]c3cccnc23)cn1 Homo sapiens CHEMBL4270414 single protein format
CHEMBL1272238 OBDepict CH 3 N H O N H O NH N O H 3 C N CH 3 H 3 C IC50 = 3.0 nM 511.63 CCNC(=O)c1ccc2c(c1)NC(=O)/C2=C(Nc1ccc(N(CCN(C)C)C(C)=O)cc1)c1ccccc1 Homo sapiens CHEMBL1272395 single protein format
CHEMBL1271736 OBDepict H 3 C N H O N H O HN N O CH 3 N H 3 C CH 3 IC50 = 3.0 nM 525.65 CCNC(=O)c1ccc2c(c1)NC(=O)/C2=C(Nc1ccc(N(CCCN(C)C)C(C)=O)cc1)c1ccccc1 Homo sapiens CHEMBL1272395 single protein format
CHEMBL2024687 OBDepict CH 3 N N N CH 3 N O N H 3 C IC50 = 3.0 nM 331.38 Cc1cccc(-n2nc(C)cc2-c2ccc3ncn(C)c(=O)c3c2)n1 Homo sapiens CHEMBL2026330 single protein format
CHEMBL1835521 OBDepict H 3 C N N N N H S N N N F F F IC50 = 3.01 nM 479.49 Cc1cccc(-c2nn(C(=S)Nc3cccc(C(F)(F)F)c3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL1835529 OBDepict H 3 C N N N N H S N N N F F F IC50 = 3.04 nM 479.49 Cc1cccc(-c2nn(C(=S)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL3260905 OBDepict N NH N H 3 C CH 3 N N H N N N H 3 C N IC50 = 3.1 nM 463.55 Cc1cccc(-c2[nH]c(CNc3cc(C#N)ccc3CN(C)C)nc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL3268788 cell-based format
CHEMBL234655 OBDepict Br F N N N H N N N N H O N O IC50 = 3.2 nM 565.41 O=C(NCCCN1CCCC1=O)c1cnccc1Nc1nc(-c2cc(Br)ccc2F)nc2nccnc12 Homo sapiens CHEMBL897419 single protein format
CHEMBL1835623 OBDepict H 3 C N N N N H S N N N F F IC50 = 3.2 nM 447.47 Cc1cccc(-c2nn(C(=S)Nc3cc(F)cc(F)c3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL3260903 OBDepict N N H N N N H O N N N H 3 C N IC50 = 3.3 nM 505.59 Cc1cccc(-c2[nH]c(CNc3cc(C#N)cc(CN4CCOCC4)c3)nc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL3268788 cell-based format
CHEMBL1835531 OBDepict H 3 C N N N N H S N N N O F F F IC50 = 3.3 nM 495.49 Cc1cccc(-c2nn(C(=S)Nc3ccc(OC(F)(F)F)cc3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL4211574 OBDepict CH 3 N N N N HN F F N IC50 = 3.4 nM 338.32 Cc1cccc(-c2nc(Nc3c(F)cncc3F)c3cccn3n2)n1 Homo sapiens CHEMBL4188411 cell-based format
CHEMBL1835525 OBDepict H 3 C N N N N H S N N N O NH 2 IC50 = 3.45 nM 454.52 Cc1cccc(-c2nn(C(=S)Nc3cccc(C(N)=O)c3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL1835626 OBDepict H 3 C N N N N H S N N N CH 3 CH 3 IC50 = 3.54 nM 439.55 Cc1cccc(-c2nn(C(=S)Nc3ccc(C)c(C)c3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL1835624 OBDepict H 3 C N N N N H S N N N Cl Cl IC50 = 3.78 nM 480.38 Cc1cccc(-c2nn(C(=S)Nc3ccc(Cl)c(Cl)c3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL1835527 OBDepict H 3 C N N N N H S N N N Cl IC50 = 3.87 nM 445.94 Cc1cccc(-c2nn(C(=S)Nc3ccc(Cl)cc3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL4206220 OBDepict F N NH N N N N N H OH H NH 2 IC50 = 3.9 nM 434.48 N[C@H]1CCN(Cc2ccn3nc(-c4ccccn4)nc(Nc4ccncc4F)c23)C[C@@H]1O Homo sapiens CHEMBL4188411 cell-based format
CHEMBL1835627 OBDepict CH 3 N N N N H S N N N CH 3 CH 3 IC50 = 3.97 nM 439.55 Cc1cc(C)cc(NC(=S)n2cc(-c3ccc4ncnn4c3)c(-c3cccc(C)n3)n2)c1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL1835621 OBDepict H 3 C N N N N H S N N N O F F F IC50 = 3.98 nM 495.49 Cc1cccc(-c2nn(C(=S)Nc3ccccc3OC(F)(F)F)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL1835520 OBDepict CH 3 N N N N H S N N N CH 3 IC50 = 3.98 nM 425.52 Cc1cccc(NC(=S)n2cc(-c3ccc4ncnn4c3)c(-c3cccc(C)n3)n2)c1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL4778963 OBDepict H 3 C N N H N N H N N H F IC50 = 4.0 nM 398.45 Cc1cccc(-c2[nH]c(CNc3cccc(F)c3)nc2-c2ccc3[nH]ncc3c2)n1 Homo sapiens CHEMBL4739183 cell-based format
CHEMBL575721 OBDepict H 3 C O HN N O N CH 3 N CH 3 IC50 = 4.0 nM 398.47 COc1cccc(Nc2cc(Oc3cc(C)c(C)nc3-c3ccccn3)ccn2)c1 Homo sapiens CHEMBL1041189 cell-based format
CHEMBL1835536 OBDepict H 3 C N N N N H S N N N H 3 C IC50 = 4.0 nM 425.52 Cc1cccc(-c2nn(C(=S)Nc3ccccc3C)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL2024685 OBDepict H 2 C N N O N N N H 3 C IC50 = 4.0 nM 329.36 C=Cn1cnc2ccc(-c3ccnn3-c3cccc(C)n3)cc2c1=O Homo sapiens CHEMBL2026330 single protein format
CHEMBL2024686 OBDepict H 3 C N N N H 3 C N O N CH 3 IC50 = 4.0 nM 331.38 Cc1cccc(-n2ncc(C)c2-c2ccc3ncn(C)c(=O)c3c2)n1 Homo sapiens CHEMBL2026330 single protein format
CHEMBL4748823 OBDepict H 3 C N N H N N H N N H IC50 = 4.0 nM 380.46 Cc1cccc(-c2[nH]c(CNc3ccccc3)nc2-c2ccc3[nH]ncc3c2)n1 Homo sapiens CHEMBL4739183 cell-based format
CHEMBL1835526 OBDepict H 3 C N N N N H S N N N F IC50 = 4.09 nM 429.48 Cc1cccc(-c2nn(C(=S)Nc3ccc(F)cc3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL1835628 OBDepict H 3 C N N N N H S N N N F F F F F F IC50 = 4.12 nM 547.49 Cc1cccc(-c2nn(C(=S)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL4214470 OBDepict F N HN N N N N N H H H H 2 N IC50 = 4.3 nM 432.51 N[C@H]1CC[C@@H](NCc2ccn3nc(-c4ccccn4)nc(Nc4ccncc4F)c23)CC1 Homo sapiens CHEMBL4188411 cell-based format
CHEMBL3704651 OBDepict H 3 C N N S N N CH 3 IC50 = 4.33 nM 320.42 CCc1cnn(-c2cccc(C)n2)c1-c1cc2cnccc2s1 Homo sapiens CHEMBL3705778 cell-based format
CHEMBL1835629 OBDepict CH 3 O O CH 3 N H N S N N N CH 3 N N IC50 = 4.37 nM 471.55 COc1ccc(NC(=S)n2cc(-c3ccc4ncnn4c3)c(-c3cccc(C)n3)n2)cc1OC Homo sapiens CHEMBL1837692 cell-based format
CHEMBL4217935 OBDepict F N NH N N N N N H OH H NH 2 IC50 = 4.4 nM 434.48 N[C@@H]1CCN(Cc2ccn3nc(-c4ccccn4)nc(Nc4ccncc4F)c23)C[C@H]1O Homo sapiens CHEMBL4188411 cell-based format
CHEMBL1835518 OBDepict H 3 C N N N N H S N N N F IC50 = 4.43 nM 429.48 Cc1cccc(-c2nn(C(=S)Nc3cccc(F)c3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL1835524 OBDepict N N H N S N N N N H 3 C N IC50 = 4.5 nM 436.5 Cc1cccc(-c2nn(C(=S)Nc3cccc(C#N)c3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format
CHEMBL3260907 OBDepict N N H N N N H O N N N CH 3 N IC50 = 4.8 nM 505.59 Cc1cccc(-c2[nH]c(CNc3cc(C#N)ccc3CN3CCOCC3)nc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL3268788 cell-based format
CHEMBL3260901 OBDepict N NH N H 3 C CH 3 N N H N N N H 3 C N IC50 = 4.9 nM 463.55 Cc1cccc(-c2[nH]c(CNc3cc(C#N)cc(CN(C)C)c3)nc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL3268788 cell-based format
CHEMBL606632 OBDepict CH 3 N O N N CH 3 H 3 C N N Ki = 5.0 nM 331.38 Cc1cccc(-c2c(-c3ccc4nccnc4c3)n(C)n(C)c2=O)n1 Homo sapiens CHEMBL1070008 single protein format
CHEMBL3260583 OBDepict H 3 C N N H N N H N N N Br IC50 = 5.0 nM 460.34 Cc1cccc(-c2[nH]c(CNc3cccc(Br)c3)nc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL3268788 cell-based format
CHEMBL3260591 OBDepict N NH N N H N N N H 3 C N IC50 = 5.0 nM 406.45 Cc1cccc(-c2[nH]c(CNc3cccc(C#N)c3)nc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL3268788 cell-based format
CHEMBL4779584 OBDepict H 3 C N N H N N H N N F H IC50 = 5.0 nM 398.45 Cc1cccc(-c2[nH]c(CNc3ccccc3F)nc2-c2ccc3[nH]ncc3c2)n1 Homo sapiens CHEMBL4739183 cell-based format
CHEMBL4747557 OBDepict H 3 C N N H N N H N N H 3 C H IC50 = 5.0 nM 394.48 Cc1cccc(-c2[nH]c(CNc3ccccc3C)nc2-c2ccc3[nH]ncc3c2)n1 Homo sapiens CHEMBL4739183 cell-based format
CHEMBL2024693 OBDepict CH 3 N N N N O N H IC50 = 5.0 nM 343.39 Cc1cccc(-n2nc3c(c2-c2ccc4nc[nH]c(=O)c4c2)CCC3)n1 Homo sapiens CHEMBL2026330 single protein format
CHEMBL4285292 OBDepict H 3 C NH O N N H N N CH 3 IC50 = 5.0 nM 343.39 CC(=O)Nc1cc(-c2[nH]c3cccnc3c2-c2ccc(C)cn2)ccn1 Homo sapiens CHEMBL4270414 single protein format
CHEMBL1835625 OBDepict H 3 C N N N N H S N N N Cl Cl IC50 = 5.08 nM 480.38 Cc1cccc(-c2nn(C(=S)Nc3cc(Cl)cc(Cl)c3)cc2-c2ccc3ncnn3c2)n1 Homo sapiens CHEMBL1837692 cell-based format