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P07384 | CAN1_HUMAN | Calpain-1 catalytic subunit (CAPN1)

3D structures mapped by conservation among orthologs

[ Domain: "Cysteine proteinases" // Peptidase_C2 ]

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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
CHEMBL89100 OBDepict O NH H O N H H S O N H O O CH 3 S O O Ki = 2.0 nM 525.65 CS(=O)(=O)N[C@H](COCc1ccccc1)C(=O)N[C@H](C=O)CCCCNS(=O)(=O)c1ccccc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL314442 OBDepict CH 3 N H H O HO O NH H O H 3 C CH 3 N H H O CH 3 CH 3 H 3 C Ki = 3.4 nM 399.53 CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(C)=O)C(=O)O Homo sapiens CHEMBL744605 single protein format
CHEMBL151521 OBDepict O HN H O CH 3 CH 3 N H H H 3 C H 3 C CH 3 O O IC50 = 4.0 nM 362.47 CC(C)C[C@@H](C=O)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C Homo sapiens CHEMBL656195 single protein format
CHEMBL150600 OBDepict O N H H H 3 C CH 3 O HN H O O CH 3 CH 3 IC50 = 4.0 nM 348.44 CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)C(C)C Homo sapiens CHEMBL656195 single protein format
CHEMBL91991 OBDepict O NH H O N H H S O O O CH 3 O Ki = 4.0 nM 510.61 CS(=O)(=O)N[C@H](COCc1ccccc1)C(=O)N[C@H](C=O)Cc1ccc(OCc2ccccc2)cc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL357595 OBDepict O N H H O H 3 C CH 3 NH H O H 3 C H 3 C N H H 3 C H O O IC50 = 5.0 nM 433.55 CC(C)C[C@H](C=O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](C)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL656195 single protein format
CHEMBL8378 OBDepict O N H H O N S H 3 C O O Cl IC50 = 5.0 nM 420.92 CCN1C(C(=O)N[C@H](C=O)Cc2ccccc2)Cc2cc(Cl)ccc2S1(=O)=O Homo sapiens CHEMBL654078 single protein format
CHEMBL280587 OBDepict NH 2 O O NH O Ki = 6.0 nM 448.52 NC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1ccccc1/C=C/c1ccc2ccccc2c1 Homo sapiens CHEMBL744606 cell-based format
CHEMBL299750 OBDepict CH 3 CH 3 HN H N H O O O H O HN O O IC50 = 6.0 nM 545.64 CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)NOCc1ccccc1 Homo sapiens CHEMBL657770 single protein format
CHEMBL92114 OBDepict O N H H O HN H S S O O CH 3 Ki = 6.0 nM 420.56 CS(=O)(=O)N[C@H](CSCc1ccccc1)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL326161 OBDepict O HN H O N CH 3 S O O O O IC50 = 6.0 nM 428.47 CN1C(C(=O)N[C@H](C=O)Cc2ccccc2)=Cc2cc3c(cc2S1(=O)=O)OCCO3 Homo sapiens CHEMBL877099 single protein format
CHEMBL345338 OBDepict O NH H O H 3 C H 3 C HN H O CH 3 CH 3 N H H O H 3 C CH 3 N H CH 3 H O O IC50 = 6.0 nM 546.71 CC(C)C[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](C)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL656195 single protein format
CHEMBL127231 OBDepict CH 3 H 3 C HN N H O O O H O OH H 3 C CH 3 IC50 = 7.0 nM 378.47 CC(C)CC(NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)O Homo sapiens CHEMBL658527 single protein format
CHEMBL92708 OBDepict CH 3 N H H O O HN H O O CH 3 CH 3 Ki = 7.0 nM 362.47 CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL821731 single protein format
CHEMBL423222 OBDepict O NH H O N H H O O H 3 C CH 3 O IC50 = 7.0 nM 502.61 CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)Cc1ccc(OCc2ccccc2)cc1 Homo sapiens CHEMBL656195 single protein format
CHEMBL118688 OBDepict O N H H O N CH 3 S O O Cl Cl IC50 = 7.0 nM 441.34 CN1C(C(=O)N[C@H](C=O)Cc2ccccc2)Cc2cc(Cl)c(Cl)cc2S1(=O)=O Homo sapiens CHEMBL877099 single protein format
CHEMBL8605 OBDepict O HN H O N H S O O IC50 = 7.0 nM 358.42 O=C[C@H](Cc1ccccc1)NC(=O)C1Cc2ccccc2S(=O)(=O)N1 Homo sapiens CHEMBL654079 single protein format
CHEMBL168471 OBDepict O HN H O CH 3 CH 3 HN H CH 3 H 3 C S O O F IC50 = 7.5 nM 372.46 CC(C)C[C@H](C=O)NC(=O)[C@@H](NS(=O)(=O)c1ccc(F)cc1)C(C)C Homo sapiens CHEMBL744609 single protein format
CHEMBL347742 OBDepict O N H H O CH 3 H 3 C HN H O O CH 3 CH 3 + N O _ O IC50 = 8.0 nM 407.47 CC(C)C[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccc([N+](=O)[O-])cc1 Homo sapiens CHEMBL656195 single protein format
CHEMBL356841 OBDepict O HN H O CH 3 CH 3 N H H O O CH 3 H 3 C IC50 = 8.0 nM 362.47 CC(C)C[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL656195 single protein format
CHEMBL269333 OBDepict O HN H O N S CH 3 O O O O IC50 = 8.0 nM 442.49 CCN1C(C(=O)N[C@H](C=O)Cc2ccccc2)=Cc2cc3c(cc2S1(=O)=O)OCCO3 Homo sapiens CHEMBL877099 single protein format
CHEMBL345337 OBDepict O HN H O CH 3 CH 3 NH H O H 3 C CH 3 N H H O O OH IC50 = 8.0 nM 525.65 CC(C)C[C@H](C=O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL656195 single protein format
CHEMBL315636 OBDepict O N H H O HN H S O O O CH 3 Ki = 8.0 nM 404.49 CS(=O)(=O)N[C@H](COCc1ccccc1)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL4092996 OBDepict H 2 N O O HN O N N N O Ki = 8.0 nM 467.49 NC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cccnc1-n1cc2c(n1)-c1ccccc1OC2 Homo sapiens CHEMBL4041003 assay format
CHEMBL286722 OBDepict O N H H O N H H CH 3 H 3 C O O Ki = 8.0 nM 382.46 CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL310855 OBDepict NH 2 O NH O Ki = 8.4 nM 420.51 NC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1/C=C/c1cccc2ccccc12 Homo sapiens CHEMBL656202 cell-based format
CHEMBL407974 OBDepict O N H N O O H 2 N O S Ki = 9.0 nM 463.56 NC(=O)C(=O)C(Cc1ccccc1)NC(=O)C1CCN(C(=O)c2cc3ccccc3s2)CC1 Homo sapiens CHEMBL744607 cell-based format
CHEMBL89766 OBDepict O N H H O N H H O CH 3 S O O CH 3 Ki = 9.0 nM 418.52 CC(OCc1ccccc1)[C@@H](NS(C)(=O)=O)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL89008 OBDepict O N H H O NH H S O O O CH 3 Ki = 9.0 nM 418.52 CCS(=O)(=O)N[C@H](COCc1ccccc1)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL90661 OBDepict O N H H O HN H S O O O S Ki = 9.0 nM 472.59 O=C[C@H](Cc1ccccc1)NC(=O)[C@@H](COCc1ccccc1)NS(=O)(=O)c1cccs1 Homo sapiens CHEMBL658530 single protein format
CHEMBL4167219 OBDepict O NH N O O NH 2 S Ki = 9.0 nM 435.55 NC(=O)C(=O)C(Cc1ccccc1)NC(=O)C1CCN(c2cc3ccccc3s2)CC1 Homo sapiens CHEMBL4132039 assay format
CHEMBL88484 OBDepict O HN H O HN H S O O CH 3 Ki = 9.0 nM 360.44 CS(=O)(=O)N[C@@H](C(=O)N[C@H](C=O)Cc1ccccc1)c1ccccc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL2371036 OBDepict H 3 C N H H O O HN H O O CH 3 CH 3 IC50 = 10.0 nM 334.42 CC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL656195 single protein format
CHEMBL420423 OBDepict O NH H O N H H S O O CH 3 N H Ki = 10.0 nM 413.5 CS(=O)(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL423112 OBDepict O NH O NH H CH 3 CH 3 O O Ki = 10.0 nM 382.46 CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC(C=O)Cc1ccccc1 Homo sapiens CHEMBL657761 single protein format
CHEMBL168909 OBDepict O N H H O H 3 C CH 3 HN H CH 3 H 3 C S O O IC50 = 10.0 nM 404.53 CC(C)C[C@H](C=O)NC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(C)C Homo sapiens CHEMBL744609 single protein format
CHEMBL341014 OBDepict O HN H O N H H O O CH 3 H 3 C IC50 = 10.0 nM 396.49 CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL656195 single protein format
CHEMBL89668 OBDepict CH 3 O NH O O N H H O N H H O O CH 3 H 3 C IC50 = 10.0 nM 469.54 CONC(=O)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL657770 single protein format
CHEMBL150134 OBDepict O NH H O H 3 C H 3 C N H H O H 3 C CH 3 HN H O CH 3 CH 3 IC50 = 10.0 nM 495.66 CC(C)C[C@H](NC(=O)c1ccc2ccccc2c1)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C=O)CC(C)C Homo sapiens CHEMBL656195 single protein format
CHEMBL151536 OBDepict O HN H O CH 3 CH 3 N H H S O O CH 3 CH 3 H 3 C IC50 = 10.0 nM 306.43 CC(C)C[C@@H](C=O)NC(=O)[C@H](CC(C)C)NS(C)(=O)=O Homo sapiens CHEMBL656195 single protein format
CHEMBL88895 OBDepict O N H H O N H H S O O CH 3 S Ki = 11.0 nM 380.49 CS(=O)(=O)N[C@H](Cc1cccs1)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL90811 OBDepict O N H H O HN H S S O O CH 3 O O Ki = 11.0 nM 452.55 CS(=O)(=O)N[C@H](CS(=O)(=O)Cc1ccccc1)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL88646 OBDepict O NH H O N H H S O O CH 3 Ki = 11.0 nM 374.46 CS(=O)(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL151829 OBDepict O HN H O N H H O O CH 3 H 3 C IC50 = 11.0 nM 402.54 CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC1CCCCC1 Homo sapiens CHEMBL656195 single protein format
CHEMBL149754 OBDepict O NH H O H 3 C H 3 C N H H O O CH 3 H 3 C IC50 = 11.0 nM 450.58 CC(C)C[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCC1c2ccccc2-c2ccccc21 Homo sapiens CHEMBL656195 single protein format
CHEMBL8486 OBDepict H HN O HO O NH 2 H H 3 C H 3 C IC50 = 11.0 nM 264.32 CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)O Homo sapiens CHEMBL654079 single protein format
CHEMBL117639 OBDepict O NH H O NH S O O O CH 3 IC50 = 11.0 nM 404.49 CS(=O)(=O)NC(COCc1ccccc1)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL654081 single protein format
CHEMBL151370 OBDepict O NH H O H 3 C H 3 C HN H O CH 3 CH 3 N H H O O IC50 = 11.0 nM 509.65 CC(C)C[C@H](C=O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL656195 single protein format
CHEMBL151937 OBDepict H 3 C N H H O O HN H O CH 3 H 3 C N H H O H 3 C H 3 C CH 3 IC50 = 12.0 nM 383.53 CCCC[C@H](C=O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(C)=O Homo sapiens CHEMBL656195 single protein format
CHEMBL150976 OBDepict O N H H O H 3 C CH 3 NH H O CH 3 H 3 C N H H O O O CH 3 H 3 C CH 3 IC50 = 12.0 nM 505.66 CC(C)C[C@H](C=O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](COC(C)(C)C)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL656195 single protein format
CHEMBL316418 OBDepict O HN O H N H O H 3 C CH 3 H O HN O O IC50 = 12.0 nM 531.61 CC(C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)NOCc1ccccc1 Homo sapiens CHEMBL657770 single protein format
CHEMBL358404 OBDepict O N H H O CH 3 H 3 C HN H O O H 3 C CH 3 CH 3 IC50 = 12.0 nM 286.37 COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C=O)CC(C)C Homo sapiens CHEMBL656195 single protein format
CHEMBL87146 OBDepict O N H H O H N S H O O O S O O IC50 = 13.0 nM 542.64 O=C[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H](OS(=O)(=O)c2ccccc2)CN1S(=O)(=O)c1ccccc1 Homo sapiens CHEMBL656842 single protein format
CHEMBL169598 OBDepict O N H H O N HN H H CH 3 H 3 C S O O Cl IC50 = 13.0 nM 461.97 CC(C)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 Homo sapiens CHEMBL744609 single protein format
CHEMBL77784 OBDepict CH 3 HN O H 2 N O N CH 3 CH 3 Ki = 13.3 nM 393.53 CCCCC(NC(=O)c1ccccc1/C=C/c1ccc(CN(C)C)cc1)C(N)=O Homo sapiens CHEMBL656202 cell-based format
CHEMBL80867 OBDepict O N H O HN H N H O S O O S N F F Ki = 14.0 nM 598.65 O=C(NCCNS(=O)(=O)c1ccc(-c2ccccn2)s1)C(=O)[C@H](Cc1ccccc1)NC(=O)c1c(F)cccc1F Homo sapiens CHEMBL658521 single protein format
CHEMBL167224 OBDepict O N H H O HN H CH 3 H 3 C S O O Cl IC50 = 14.0 nM 422.93 CC(C)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)N[C@@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL744609 single protein format
CHEMBL316010 OBDepict O N H H O H N S O O CH 3 IC50 = 14.0 nM 400.5 Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)N[C@H](C=O)Cc2ccccc2)cc1 Homo sapiens CHEMBL656842 single protein format
CHEMBL169307 OBDepict O HN H O HN H H 3 C CH 3 S O O IC50 = 14.0 nM 438.55 CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N[C@@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL744609 single protein format
CHEMBL80903 OBDepict O NH O Ki = 15.0 nM 405.5 O=CC(Cc1ccccc1)NC(=O)c1ccccc1/C=C/c1cccc2ccccc12 Homo sapiens CHEMBL656202 cell-based format
CHEMBL280654 OBDepict O NH O Ki = 15.0 nM 405.5 O=CC(Cc1ccccc1)NC(=O)c1ccccc1/C=C/c1ccc2ccccc2c1 Homo sapiens CHEMBL744606 cell-based format
CHEMBL150256 OBDepict O N H H O CH 3 H 3 C HN H O H 3 C CH 3 N O O IC50 = 15.0 nM 521.66 CC(C)C[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)C1Cc2ccccc2CN1C(=O)OCc1ccccc1 Homo sapiens CHEMBL656195 single protein format
CHEMBL421043 OBDepict O HN H O N CH 3 S O O Cl Cl IC50 = 15.0 nM 439.32 CN1C(C(=O)N[C@H](C=O)Cc2ccccc2)=Cc2cc(Cl)c(Cl)cc2S1(=O)=O Homo sapiens CHEMBL877099 single protein format
CHEMBL117553 OBDepict O N H H O N CH 3 S O O Cl IC50 = 15.0 nM 406.89 CN1C(C(=O)N[C@H](C=O)Cc2ccccc2)Cc2cc(Cl)ccc2S1(=O)=O Homo sapiens CHEMBL656196 single protein format
CHEMBL151206 OBDepict O N H H O CH 3 H 3 C HN H O H 3 C CH 3 N H H O CH 3 CH 3 CH 3 IC50 = 15.0 nM 383.53 CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C=O)CC(C)C Homo sapiens CHEMBL656195 single protein format
CHEMBL424142 OBDepict O N H H O N N H H N H O O CH 3 H 3 C IC50 = 15.0 nM 386.45 CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)Cc1c[nH]cn1 Homo sapiens CHEMBL656195 single protein format
CHEMBL423112 OBDepict O NH O NH H CH 3 CH 3 O O IC50 = 17.0 nM 382.46 CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC(C=O)Cc1ccccc1 Homo sapiens CHEMBL654084 single protein format
CHEMBL4095528 OBDepict O HN O H 2 N O N N N Ki = 18.0 nM 439.48 NC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cccnc1-n1ccc(-c2ccccc2)n1 Homo sapiens CHEMBL4041003 assay format
CHEMBL169551 OBDepict O N H H O HN H CH 3 H 3 C S O O H 3 C IC50 = 18.0 nM 402.52 Cc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H](C=O)Cc2ccccc2)C(C)C)cc1 Homo sapiens CHEMBL744609 single protein format
CHEMBL151468 OBDepict O N H H O CH 3 H 3 C HN H O H 3 C CH 3 HN CH 3 H O CH 3 IC50 = 18.0 nM 341.45 CC(=O)N[C@@H](C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C=O)CC(C)C Homo sapiens CHEMBL656195 single protein format
CHEMBL80933 OBDepict CH 3 N CH 3 N N H O O H 2 N Ki = 18.3 nM 428.54 CN(C)Cc1ccc(/C=C/c2ncccc2C(=O)NC(Cc2ccccc2)C(N)=O)cc1 Homo sapiens CHEMBL656202 cell-based format
CHEMBL132586 OBDepict H 3 C HN O HN O O N H N O O CH 3 CH 3 Ki = 19.0 nM 482.58 CCCC(NC(=O)C(CC(C)C)NC(=O)OCc1ccccc1)C(=O)C(=O)NCc1ccccn1 Homo sapiens CHEMBL656201 single protein format
CHEMBL151176 OBDepict O N H H O H 3 C CH 3 NH H O CH 3 H 3 C N H H O O CH 3 H 3 C IC50 = 19.0 nM 475.63 CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C=O)CC(C)C Homo sapiens CHEMBL656195 single protein format
CHEMBL301598 OBDepict H 3 C O HN O O NH H O N H H O O H 3 C CH 3 IC50 = 19.0 nM 483.57 CCONC(=O)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL657770 single protein format
CHEMBL4068214 OBDepict CH 3 N H O O NH 2 O N N N Ki = 20.0 nM 405.46 CCCCC(NC(=O)c1cccnc1-n1cc(-c2ccccc2)cn1)C(=O)C(N)=O Homo sapiens CHEMBL4041003 assay format
CHEMBL316135 OBDepict H 3 C O NH O O NH H O N H H O H 3 C CH 3 N H H O O CH 3 H 3 C IC50 = 20.0 nM 582.7 CONC(=O)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL657770 single protein format
CHEMBL151415 OBDepict H 2 N N H H N H O O O H N H O CH 3 H 3 C H O CH 3 CH 3 IC50 = 20.0 nM 490.65 CC(C)C[C@H](C=O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL656195 single protein format
CHEMBL333995 OBDepict CH 3 CH 3 N H H N H O O H OH O N IC50 = 20.0 nM 451.57 CC(C)C[C@H](NC(=O)c1ccc2c(c1)CCN2Cc1ccccc1)C(=O)N[C@H]1CCOC1O Homo sapiens CHEMBL654082 single protein format
CHEMBL8703 OBDepict O N H H O N H S O O IC50 = 20.0 nM 436.53 O=C[C@H](Cc1ccccc1)NC(=O)C(Cc1ccccc1)NS(=O)(=O)c1ccccc1 Homo sapiens CHEMBL654081 single protein format
CHEMBL4277595 OBDepict H 3 C O N H N N H O N H 3 C O CH 3 IC50 = 20.0 nM 356.43 COCCN/C(=C1/N=C(C)N(CCOC)C1=O)c1cc2ccccc2[nH]1 Homo sapiens CHEMBL4263564 single protein format
CHEMBL4077634 OBDepict O NH O NH 2 O N N N Ki = 21.0 nM 439.48 NC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cccnc1-n1cc(-c2ccccc2)cn1 Homo sapiens CHEMBL4041003 assay format
CHEMBL76145 OBDepict H 3 C CH 3 N H O H O N H O HN S O O S N Ki = 21.0 nM 556.71 CC(C)CCC(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)NCCNS(=O)(=O)c1ccc(-c2ccccn2)s1 Homo sapiens CHEMBL656203 single protein format
CHEMBL419311 OBDepict CH 3 CH 3 HN H N H O O O H O N H O O CH 3 IC50 = 21.0 nM 551.68 CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)NOC1CCC(C)CC1 Homo sapiens CHEMBL657770 single protein format
CHEMBL85296 OBDepict H 3 C N H H O HN O O O N H H H 3 C CH 3 O O IC50 = 21.0 nM 497.59 CCCC[C@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C)C(=O)C(=O)NOCc1ccccc1 Homo sapiens CHEMBL657770 single protein format
CHEMBL209457 OBDepict CH 3 NH O O N H H O H 3 C CH 3 HN H CH 3 H 3 C S O O F IC50 = 21.0 nM 471.6 CCCCNC(=O)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NS(=O)(=O)c1ccc(F)cc1)C(C)C Homo sapiens CHEMBL863671 single protein format
CHEMBL313712 OBDepict O N H H O HN H S O O O Ki = 22.0 nM 466.56 O=C[C@H](Cc1ccccc1)NC(=O)[C@@H](COCc1ccccc1)NS(=O)(=O)c1ccccc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL288365 OBDepict O HN H O CH 3 CH 3 HN H CH 3 H 3 C S O O F IC50 = 22.0 nM 372.46 CC(C)C[C@@H](C=O)NC(=O)[C@@H](NS(=O)(=O)c1ccc(F)cc1)C(C)C Homo sapiens CHEMBL863671 single protein format
CHEMBL3706732 OBDepict H 3 C CH 3 NH H NH O O H OH O NH S IC50 = 22.5 nM 441.55 CC(C)C[C@H](NC(=O)c1ccc2c(c1)Nc1ccccc1S2)C(=O)N[C@H]1CCOC1O Homo sapiens CHEMBL654082 single protein format
CHEMBL318779 OBDepict H 3 C S N H H O O HN H O CH 3 H 3 C N H H O H 3 C H 3 C CH 3 IC50 = 23.0 nM 401.57 CSCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(C)=O Homo sapiens CHEMBL656195 single protein format
CHEMBL169573 OBDepict O N H H O N HN H H CH 3 H 3 C S O O F IC50 = 23.0 nM 445.52 CC(C)[C@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 Homo sapiens CHEMBL744609 single protein format
CHEMBL115954 OBDepict O N H H O N CH 3 S O O O O IC50 = 24.0 nM 430.48 CN1C(C(=O)N[C@H](C=O)Cc2ccccc2)Cc2cc3c(cc2S1(=O)=O)OCCO3 Homo sapiens CHEMBL877099 single protein format
CHEMBL358158 OBDepict O NH H O H 3 C H 3 C N H H O CH 3 H 3 C HN H O O O O CH 3 H 3 C CH 3 IC50 = 25.0 nM 547.69 CC(C)C[C@H](C=O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCC(=O)OC(C)(C)C)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL656195 single protein format
CHEMBL42716 OBDepict O N H H O CH 3 CH 3 H O H 3 C CH 3 O IC50 = 25.0 nM 435.56 CC(C)C[C@@H](C=O)NC(=O)[C@@H](CC(=O)C1c2ccccc2Oc2ccccc21)CC(C)C Homo sapiens CHEMBL654084 single protein format
CHEMBL4462518 OBDepict O N H H N O O O H 2 N F F F Ki = 26.0 nM 461.44 NC(=O)C(=O)C(Cc1ccccc1)NC(=O)[C@H]1CCC(=O)N1Cc1cccc(C(F)(F)F)c1 Homo sapiens CHEMBL4389016 single protein format
CHEMBL441262 OBDepict CH 3 H 3 C NH H N H O O O H O NH O O H 3 C H 3 C CH 3 IC50 = 26.0 nM 511.62 CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)NOC(C)(C)C Homo sapiens CHEMBL657770 single protein format
CHEMBL80605 OBDepict CH 3 N CH 3 N H O O H 2 N Ki = 27.0 nM 455.6 CCN(CC)Cc1ccc(/C=C/c2ccccc2C(=O)NC(Cc2ccccc2)C(N)=O)cc1 Homo sapiens CHEMBL656202 cell-based format
CHEMBL169690 OBDepict O N H H O HN H CH 3 H 3 C S O O F IC50 = 27.0 nM 406.48 CC(C)[C@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL744609 single protein format
CHEMBL88854 OBDepict O NH H O N H H S O O CH 3 Ki = 28.0 nM 388.49 CS(=O)(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](C=O)Cc1ccccc1 Homo sapiens CHEMBL658530 single protein format
CHEMBL420698 OBDepict O HN H O N CH 3 S O O IC50 = 28.0 nM 372.45 CN1C(C(=O)N[C@H](C=O)Cc2ccccc2)Cc2ccccc2S1(=O)=O Homo sapiens CHEMBL877099 single protein format
CHEMBL2367774 OBDepict O N H H O H N S H O O CH 3 N IC50 = 28.0 nM 425.51 Cc1ccc(S(=O)(=O)N2C[C@H](C#N)C[C@H]2C(=O)N[C@H](C=O)Cc2ccccc2)cc1 Homo sapiens CHEMBL656842 single protein format