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P37173 | TGFR2_HUMAN | TGF-beta receptor type-2 (TGFBR2)

3D structures mapped by conservation among orthologs

[ Domain: "Protein kinase" // Pkinase_Tyr ]

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[ Domain: "Snake toxin-like" // ecTbetaR2 ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL4791414 OBDepict H 3 C N N N O N N OH CH 3 H 3 C N O IC50 = 0.31 nM 420.47 Cn1cc(-c2nc3c(-c4ccnc(OC5CC5)c4)cnn3cc2OCC(C)(C)O)cn1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4758580 OBDepict CH 3 O N N N N N CH 3 N O CH 3 H 3 C IC50 = 0.56 nM 364.41 COc1cn2ncc(-c3ccnc(OC(C)C)c3)c2nc1-c1cnn(C)c1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4787891 OBDepict CH 3 O N N N N N CH 3 N O IC50 = 0.61 nM 376.42 COc1cn2ncc(-c3ccnc(OC4CCC4)c3)c2nc1-c1cnn(C)c1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4751832 OBDepict CH 3 N N N O N N OH H 3 C H 3 C N O IC50 = 0.83 nM 434.5 Cn1cc(-c2nc3c(-c4ccnc(OC5CC5)c4)cnn3cc2OCCC(C)(C)O)cn1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4749011 OBDepict CH 3 O N N N N N CH 3 N O H 3 C IC50 < 1.0 nM 336.36 COc1cc(-c2cnn3cc(OC)c(-c4cnn(C)c4)nc23)ccn1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4748097 OBDepict CH 3 O N N N N CH 3 H 3 C O H 3 C IC50 = 1.0 nM 298.35 COc1cc(-c2cnn3cc(OC)c(C(C)C)nc23)ccn1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4752199 OBDepict H 3 C O N N N N N H H 3 C O H 3 C IC50 = 1.0 nM 285.31 CNc1nc2c(-c3ccnc(OC)c3)cnn2cc1OC Homo sapiens CHEMBL4714984 single protein format
CHEMBL4779273 OBDepict CH 3 O N N N N O O CH 3 IC50 = 1.1 nM 326.36 COc1cc(-c2cnn3cc(OC)c(C4CCOC4)nc23)ccn1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4782729 OBDepict H 3 C O N N N N O CH 3 IC50 = 1.2 nM 324.38 COc1cc(-c2cnn3cc(OC)c(C4CCCC4)nc23)ccn1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL2385579 OBDepict H N N N N N N O IC50 = 1.37 nM 346.39 c1cc(N2CCOCC2)ccc1-c1cnc2c(-c3cn[nH]c3)cnn2c1 Homo sapiens CHEMBL2390518 single protein format
CHEMBL4741185 OBDepict CH 3 N H N N CH 3 N N O CH 3 IC50 = 1.5 nM 283.34 CCc1cn2ncc(-c3ccnc(OC)c3)c2nc1NC Homo sapiens CHEMBL4714984 single protein format
CHEMBL4744618 OBDepict CH 3 O N N N N N CH 3 N O IC50 = 1.6 nM 362.39 COc1cn2ncc(-c3ccnc(OC4CC4)c3)c2nc1-c1cnn(C)c1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4764221 OBDepict H 3 C N N N O N N N O HO H 3 C CH 3 IC50 = 2.0 nM 448.53 Cn1cc(-c2nc3c(-c4ccnc(OC5CC5)c4)cnn3cc2OCCCC(C)(C)O)cn1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4779579 OBDepict CH 3 N H N CH 3 N N N O H 3 C IC50 = 2.9 nM 269.31 CNc1nc2c(-c3ccnc(OC)c3)cnn2cc1C Homo sapiens CHEMBL4714984 single protein format
CHEMBL4763627 OBDepict CH 3 O N N N O N H 3 C N O CH 3 IC50 = 2.9 nM 337.34 COc1cc(-c2cnn3cc(OC)c(-c4cc(C)no4)nc23)ccn1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4792464 OBDepict CH 3 O N N N H O H 3 C H 3 C N O CH 3 IC50 < 3.0 nM 354.41 COc1cc(-c2cnn3cc(OC)c([C@H]4COC(C)(C)C4)nc23)ccn1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4741913 OBDepict CH 3 N H N N CH 2 N N O CH 3 IC50 < 3.0 nM 281.32 C=Cc1cn2ncc(-c3ccnc(OC)c3)c2nc1NC Homo sapiens CHEMBL4714984 single protein format
CHEMBL4764416 OBDepict CH 3 O N N N N O OH H 3 C H 3 C H 3 C IC50 = 3.3 nM 314.35 COc1cc(-c2cnn3cc(OC)c(C(C)(C)O)nc23)ccn1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4749061 OBDepict CH 3 O N N N H O H 3 C H 3 C N O CH 3 IC50 = 3.6 nM 354.41 COc1cc(-c2cnn3cc(OC)c([C@@H]4COC(C)(C)C4)nc23)ccn1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4744988 OBDepict CH 3 N H N N N N O CH 3 IC50 = 3.7 nM 295.35 CNc1nc2c(-c3ccnc(OC)c3)cnn2cc1C1CC1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4795223 OBDepict H 3 C N H N N N N O H 3 C IC50 = 3.9 nM 255.28 CNc1ccn2ncc(-c3ccnc(OC)c3)c2n1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4798505 OBDepict CH 3 O N N N N H 3 C O H 3 C IC50 = 5.0 nM 270.29 COc1cc(-c2cnn3cc(OC)c(C)nc23)ccn1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4747422 OBDepict CH 3 O N N N N N CH 3 N O H 3 C H 3 C CH 3 IC50 = 7.0 nM 378.44 COc1cn2ncc(-c3ccnc(OC(C)(C)C)c3)c2nc1-c1cnn(C)c1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4289841 OBDepict H 3 C NH O N N H N N F IC50 = 7.0 nM 347.35 CC(=O)Nc1cc(-c2[nH]c3cccnc3c2-c2ccc(F)nc2)ccn1 Homo sapiens CHEMBL4270415 single protein format
CHEMBL4777071 OBDepict CH 3 O N N N N N CH 3 H 3 C O H 3 C IC50 = 7.9 nM 299.33 COc1cc(-c2cnn3cc(OC)c(N(C)C)nc23)ccn1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4750258 OBDepict CH 3 O N N N N O CH 3 IC50 = 15.0 nM 256.26 COc1cnc2c(-c3ccnc(OC)c3)cnn2c1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL2385596 OBDepict CH 3 N N N N N N IC50 = 15.0 nM 420.52 CN1CCN(c2ccc(-c3cnc4c(-c5ccnc6ccccc56)cnn4c3)cc2)CC1 Homo sapiens CHEMBL2390518 single protein format
CHEMBL2385600 OBDepict H 3 C O N N N N N H IC50 = 16.0 nM 291.31 COc1ccc(-c2cnc3c(-c4cn[nH]c4)cnn3c2)cc1 Homo sapiens CHEMBL2390518 single protein format
CHEMBL2385582 OBDepict O N N N N N IC50 = 26.0 nM 407.48 c1ccc2c(-c3cnn4cc(-c5ccc(N6CCOCC6)cc5)cnc34)ccnc2c1 Homo sapiens CHEMBL2390518 single protein format
CHEMBL4763122 OBDepict H 3 C O N N N N H 3 C O H 3 C IC50 = 36.0 nM 284.32 CCc1nc2c(-c3ccnc(OC)c3)cnn2cc1OC Homo sapiens CHEMBL4714984 single protein format
CHEMBL2385586 OBDepict H N N N N N N HN IC50 = 38.0 nM 345.41 c1cc(N2CCNCC2)ccc1-c1cnc2c(-c3cn[nH]c3)cnn2c1 Homo sapiens CHEMBL2390518 single protein format
CHEMBL4279160 OBDepict CH 3 O N N N H N N H O CH 3 IC50 = 40.0 nM 359.39 COc1ccc(-c2c(-c3ccnc(NC(C)=O)c3)[nH]c3cccnc23)cn1 Homo sapiens CHEMBL4270415 single protein format
CHEMBL440084 OBDepict NH 2 O N N H N O O IC50 = 66.0 nM 384.4 NC(=O)c1ccc(-c2nc(-c3ccccn3)c(-c3ccc4c(c3)OCO4)[nH]2)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL4783244 OBDepict O N H O N N N IC50 = 75.0 nM 296.33 c1cc2cc(c1)-c1cnn3ccc(nc13)NCCOCCO2 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4205311 OBDepict N N H N N N N IC50 = 77.0 nM 288.31 c1ccc(-c2nc(Nc3ccncc3)c3cccn3n2)nc1 Homo sapiens CHEMBL4188412 single protein format
CHEMBL478629 OBDepict N O N N N N IC50 = 102.9 nM 399.5 c1cc(-c2cnn3cc(-c4ccc(OCCN5CCCCC5)cc4)cnc23)ccn1 Homo sapiens CHEMBL2390518 single protein format
CHEMBL4204772 OBDepict F N N H N N N N IC50 = 110.0 nM 306.3 Fc1cnccc1Nc1nc(-c2ccccn2)nn2cccc12 Homo sapiens CHEMBL4188412 single protein format
CHEMBL4747912 OBDepict H 3 C O O N H H 3 C N H O S N O NH 2 O N IC50 = 110.0 nM 443.49 COc1cc(CNC(=O)Nc2snc(OCc3cccnc3)c2C(N)=O)cc(OC)c1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL513147 OBDepict HN N N N N N IC50 = 140.4 nM 406.49 c1ccc2c(-c3cnn4cc(-c5ccc(N6CCNCC6)cc5)cnc34)ccnc2c1 Homo sapiens CHEMBL2390518 single protein format
CHEMBL2180266 OBDepict H 3 C O NH CH 3 O O CH 3 H 3 C H 3 C CH 3 IC50 = 170.0 nM 409.57 CCCC1CC(=O)C2=C(C1)NC(C)=C(C(=O)OCC)C2c1ccc(C(C)(C)C)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL2180267 OBDepict H 3 C O NH CH 3 O O H 3 C H 3 C CH 3 CH 3 CH 3 IC50 = 170.0 nM 437.62 CCCC1CC(=O)C2=C(C1)NC(C)=C(C(=O)OCC(C)C)C2c1ccc(C(C)(C)C)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL4786529 OBDepict F F N N H 3 C N N HN IC50 = 170.7 nM 455.51 Cc1cc(-c2cnc3cc(-c4ccc(N5CCNCC5)cc4)ccn23)c2cc(F)cc(F)c2n1 Homo sapiens CHEMBL4727760 single protein format
CHEMBL260015 OBDepict O N O N N N N IC50 = 190.0 nM 441.54 c1ccc(-c2nn3c(c2-c2ccnc4cc(OCCN5CCOCC5)ccc24)CCC3)nc1 Homo sapiens CHEMBL4188412 single protein format
CHEMBL511563 OBDepict CH 3 O N N N N IC50 = 236.0 nM 352.4 COc1ccc(-c2cnc3c(-c4ccnc5ccccc45)cnn3c2)cc1 Homo sapiens CHEMBL2390518 single protein format
CHEMBL4210246 OBDepict H 3 C N N N NH N H F N IC50 = 310.0 nM 320.33 Cc1cccc(-c2nc(Nc3ccncc3F)c3cc[nH]c3n2)n1 Homo sapiens CHEMBL4188412 single protein format
CHEMBL2385591 OBDepict HN N N N N N IC50 = 327.0 nM 406.49 c1cc(-c2cnn3cc(-c4ccc(N5CCNCC5)cc4)cnc23)c2cccnc2c1 Homo sapiens CHEMBL2390518 single protein format
CHEMBL203619 OBDepict HO N N N N N IC50 = 352.0 nM 359.43 OCCCn1cnc2ccc(-c3c(-c4ccccn4)nn4c3CCC4)cc21 Homo sapiens CHEMBL861563 cell-based format
CHEMBL4291307 OBDepict H 3 C NH O N N H N N F IC50 = 390.0 nM 347.35 CC(=O)Nc1cc(-c2[nH]c3cccnc3c2-c2ccc(F)cn2)ccn1 Homo sapiens CHEMBL4270415 single protein format
CHEMBL204170 OBDepict CH 3 N N N N N IC50 = 395.0 nM 315.38 Cn1cnc2ccc(-c3c(-c4ccccn4)nn4c3CCC4)cc21 Homo sapiens CHEMBL861563 cell-based format
CHEMBL261454 OBDepict H N N N N IC50 = 400.0 nM 272.31 c1ccc(-c2n[nH]cc2-c2ccnc3ccccc23)nc1 Homo sapiens CHEMBL861563 cell-based format
CHEMBL2180268 OBDepict H 3 C O NH CH 3 O O CH 3 IC50 = 400.0 nM 415.53 CCCC1CC(=O)C2=C(C1)NC(C)=C(C(=O)OC)C2c1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL2180273 OBDepict CH 3 O O H 3 C HN O CH 3 H 3 C IC50 = 460.0 nM 415.53 CCOC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)C1c1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL4792978 OBDepict CH 3 N N H 2 N NH O IC50 = 490.0 nM 310.4 Cc1ccc(-c2cnc(N)c(C(=O)NC3CCCCC3)n2)cc1 Homo sapiens CHEMBL4714984 single protein format
CHEMBL4778971 OBDepict F F N N H 3 C N N H N H IC50 = 498.0 nM 455.51 Cc1cc(-c2cnc3cc(-c4ccc(C5CNCCN5)cc4)ccn23)c2cc(F)cc(F)c2n1 Homo sapiens CHEMBL4727760 single protein format
CHEMBL2180281 OBDepict H 3 C CH 3 O O CH 3 HN O H 3 C H 3 C IC50 = 530.0 nM 443.59 CC1=C(C(=O)OCC(C)C)C(c2ccc(-c3ccccc3)cc2)C2=C(CC(C)(C)CC2=O)N1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL4206793 OBDepict H 3 C N N N N N H N IC50 = 550.0 nM 302.34 Cc1cccc(-c2nc(Nc3ccncc3)c3cccn3n2)n1 Homo sapiens CHEMBL4188412 single protein format
CHEMBL2180618 OBDepict CH 3 O O H 3 C HN O CH 3 H 3 C CH 3 CH 3 CH 3 IC50 = 560.0 nM 381.52 COC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)C1c1ccc(C(C)(C)C)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL4205457 OBDepict CH 3 N N N N HN F N IC50 = 570.0 nM 320.33 Cc1cccc(-c2nc(Nc3ccncc3F)c3cccn3n2)n1 Homo sapiens CHEMBL4188412 single protein format
CHEMBL4788859 OBDepict F N N H 3 C N N HN IC50 = 587.2 nM 437.52 Cc1cc(-c2cnc3cc(-c4ccc(N5CCNCC5)cc4)ccn23)c2cc(F)ccc2n1 Homo sapiens CHEMBL4727760 single protein format
CHEMBL2180287 OBDepict H 3 C O O CH 3 NH O H 3 C CH 3 IC50 = 590.0 nM 407.55 COC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)C1c1ccc(C2CCCCC2)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL2180270 OBDepict H 3 C O O CH 3 NH O CH 3 CH 3 IC50 = 590.0 nM 429.56 COC(=O)C1=C(C)NC2=C(C(=O)CC(CC(C)C)C2)C1c1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL204966 OBDepict CH 3 N N N N N H 3 C IC50 = 668.0 nM 329.41 Cc1cccc(-c2nn3c(c2-c2ccc4ncn(C)c4c2)CCC3)n1 Homo sapiens CHEMBL861563 cell-based format
CHEMBL204063 OBDepict HO N N N N N H 3 C IC50 = 690.0 nM 373.46 Cc1cccc(-c2nn3c(c2-c2ccc4ncn(CCCO)c4c2)CCC3)n1 Homo sapiens CHEMBL861563 cell-based format
CHEMBL4283638 OBDepict H 3 C N N N N S O O NH 2 IC50 = 698.0 nM 497.62 CC(c1ccc(-c2cnc3c(-c4ccc(S(N)(=O)=O)c5ccccc45)cnn3c2)cc1)N1CCCC1 Homo sapiens CHEMBL4263990 assay format
CHEMBL4292047 OBDepict CH 3 HN O N N H N N H 3 C IC50 = 730.0 nM 343.39 CC(=O)Nc1cc(-c2[nH]c3cccnc3c2-c2cccc(C)n2)ccn1 Homo sapiens CHEMBL4270415 single protein format
CHEMBL2180612 OBDepict H 3 C O O CH 3 NH O H 3 C CH 3 F F F IC50 = 730.0 nM 469.5 COC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)C1c1ccc(-c2ccc(C(F)(F)F)cc2)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL2180280 OBDepict O O CH 3 NH F F F O CH 3 CH 3 IC50 = 760.0 nM 469.5 CC1=C(C(=O)OCC(F)(F)F)C(c2ccc(-c3ccccc3)cc2)C2=C(CC(C)(C)CC2=O)N1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL2177136 OBDepict CH 3 O HN CH 3 O O CH 3 IC50 = 790.0 nM 401.51 CCC1CC(=O)C2=C(C1)NC(C)=C(C(=O)OC)C2c1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL4206220 OBDepict F N NH N N N N N H OH H NH 2 IC50 = 810.0 nM 434.48 N[C@H]1CCN(Cc2ccn3nc(-c4ccccn4)nc(Nc4ccncc4F)c23)C[C@@H]1O Homo sapiens CHEMBL4188412 single protein format
CHEMBL4455462 OBDepict F F N N N N N CH 3 O H 2 N IC50 = 820.0 nM 382.37 Cc1cccc(-c2ncn(CC(F)F)c2-c2ccc3ncc(C(N)=O)n3c2)n1 Homo sapiens CHEMBL4339025 single protein format
CHEMBL2180285 OBDepict H 3 C O O NH CH 3 O CH 3 CH 3 IC50 = 830.0 nM 443.59 CCCC1=C(C(=O)OCC)C(c2ccc(-c3ccccc3)cc2)C2=C(CC(C)(C)CC2=O)N1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL2180283 OBDepict CH 3 O O O CH 3 HN O H 3 C H 3 C IC50 = 830.0 nM 507.63 COc1ccc(COC(=O)C2=C(C)NC3=C(C(=O)CC(C)(C)C3)C2c2ccc(-c3ccccc3)cc2)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL2180611 OBDepict CH 3 O O H 3 C HN O CH 3 H 3 C CH 3 IC50 = 860.0 nM 415.53 COC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)C1c1ccc(-c2ccc(C)cc2)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL2180614 OBDepict CH 3 O O H 3 C HN O CH 3 H 3 C H 3 C IC50 = 890.0 nM 415.53 COC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)C1c1ccc(-c2ccccc2C)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL4209583 OBDepict H 3 C HN O N NH N N N N H F F F IC50 = 940.0 nM 413.36 CC(=O)Nc1cc(Nc2nc(-c3cccc(C(F)(F)F)n3)nc3[nH]ccc23)ccn1 Homo sapiens CHEMBL4188412 single protein format
CHEMBL2180269 OBDepict CH 3 O O H 3 C HN O CH 3 H 3 C IC50 = 940.0 nM 415.53 COC(=O)C1=C(C)NC2=C(C(=O)CC(C(C)C)C2)C1c1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL2182430 cell-based format
CHEMBL4745367 OBDepict CH 3 O N N N N H CH 3 IC50 = 1000.0 nM 254.29 CNc1ccn2ncc(-c3cccc(OC)c3)c2n1 Homo sapiens CHEMBL4714984 single protein format