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P48147 | PPCE_HUMAN | Prolyl endopeptidase (PREP)

3D structures mapped by conservation among orthologs

[ Domain: "7-bladed" // Peptidase_S9_N ]

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[ Domain: "alpha/beta-Hydrolases" // Hydrolase_4 ]

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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
CHEMBL189620 OBDepict N H N O H N O Ki = 0.023 nM 339.44 N#C[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CCCc1ccccc1 Homo sapiens CHEMBL3241125 single protein format
CHEMBL318630 OBDepict O N H N O H O N O O Ki = 0.34 nM 529.64 O=C(c1cc(COCc2ccccc2)on1)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CCCc1ccccc1 Homo sapiens CHEMBL765810 single protein format
CHEMBL302654 OBDepict O H N O H N O IC50 = 0.42 nM 354.45 O=C[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CC1Cc2ccccc2C1 Homo sapiens CHEMBL765791 assay format
CHEMBL65284 OBDepict O H N O H N O H IC50 = 0.45 nM 368.48 O=C[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)C[C@H]1CCc2ccccc2C1 Homo sapiens CHEMBL765791 assay format
CHEMBL291393 OBDepict O H N O H N S O H IC50 = 0.46 nM 386.52 O=C[C@@H]1CCCN1C(=O)[C@@H]1CSCN1C(=O)C[C@H]1CCc2ccccc2C1 Homo sapiens CHEMBL765791 assay format
CHEMBL22766 OBDepict O N S O N S O O IC50 = 0.5 nM 366.46 O=CC1CSCN1C(=O)C1CSCN1C(=O)OCc1ccccc1 Homo sapiens CHEMBL765792 assay format
CHEMBL63745 OBDepict N H N O H N O H IC50 = 0.52 nM 365.48 N#C[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)C[C@H]1CCc2ccccc2C1 Homo sapiens CHEMBL765791 assay format
CHEMBL294367 OBDepict N H N O H N S O H IC50 = 0.55 nM 383.52 N#C[C@@H]1CCCN1C(=O)[C@@H]1CSCN1C(=O)C[C@H]1CCc2ccccc2C1 Homo sapiens CHEMBL765791 assay format
CHEMBL2333024 OBDepict O NH N H N O H 3 C H 3 C H B OH OH Ki = 0.73 nM 319.17 CC(C)[C@H](NC(=O)c1cccnc1)C(=O)N1CCC[C@H]1B(O)O Homo sapiens CHEMBL2345667 single protein format
CHEMBL3817958 OBDepict N H N O H H O N H Ki = 0.75 nM 349.43 N#C[C@@H]1CCCN1C(=O)[C@@H]1CC=C[C@H]2CN(Cc3ccccc3)C(=O)[C@@H]21 Homo sapiens CHEMBL3819963 single protein format
CHEMBL65512 OBDepict O H N S O H N S O H IC50 = 0.85 nM 404.56 O=C[C@@H]1CSCN1C(=O)[C@@H]1CSCN1C(=O)C[C@H]1CCc2ccccc2C1 Homo sapiens CHEMBL765791 assay format
CHEMBL289651 OBDepict O N H N O Ki = 0.97 nM 314.43 O=C([C@@H]1CCCN1C(=O)CCCc1ccccc1)N1CCCC1 Homo sapiens CHEMBL3241125 single protein format
CHEMBL4746891 OBDepict N H N F F O NH O N S S Cl Cl IC50 = 1.0 nM 491.37 N#C[C@@H]1CC(F)(F)CN1C(=O)CNC(=O)c1csc(CSc2ccc(Cl)c(Cl)c2)n1 Homo sapiens CHEMBL4714148 single protein format
CHEMBL4758377 OBDepict N H N F F O N H O N S I IC50 = 1.0 nM 516.31 N#C[C@@H]1CC(F)(F)CN1C(=O)CNC(=O)c1csc(Cc2ccccc2I)n1 Homo sapiens CHEMBL4714148 single protein format
CHEMBL4762591 OBDepict N H N F F O N H O N S Cl Cl IC50 = 1.0 nM 459.31 N#C[C@@H]1CC(F)(F)CN1C(=O)CNC(=O)c1csc(Cc2ccc(Cl)cc2Cl)n1 Homo sapiens CHEMBL4714148 single protein format
CHEMBL65338 OBDepict O H N O H N S O IC50 = 1.0 nM 372.49 O=C[C@@H]1CCCN1C(=O)[C@@H]1CSCN1C(=O)CC1Cc2ccccc2C1 Homo sapiens CHEMBL765791 assay format
CHEMBL66088 OBDepict N H N O H N S O IC50 = 1.1 nM 369.49 N#C[C@@H]1CCCN1C(=O)[C@@H]1CSCN1C(=O)CC1Cc2ccccc2C1 Homo sapiens CHEMBL765791 assay format
CHEMBL79993 OBDepict O H N O H N O O IC50 = 1.1 nM 330.38 O=C[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1 Homo sapiens CHEMBL765791 assay format
CHEMBL62580 OBDepict N H N O H N O IC50 = 1.2 nM 351.45 N#C[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CC1Cc2ccccc2C1 Homo sapiens CHEMBL765791 assay format
CHEMBL4464623 OBDepict O NH H N N O H 3 C H 3 C H B OH OH IC50 = 1.3 nM 319.17 CC(C)[C@H](NC(=O)c1ccncc1)C(=O)N1CCC[C@H]1B(O)O Homo sapiens CHEMBL4336748 single protein format
CHEMBL2333024 OBDepict O NH N H N O H 3 C H 3 C H B OH OH IC50 = 1.3 nM 319.17 CC(C)[C@H](NC(=O)c1cccnc1)C(=O)N1CCC[C@H]1B(O)O Homo sapiens CHEMBL2346128 single protein format
CHEMBL1086968 OBDepict O N H H H H N O H S Ki = 1.5 nM 384.55 O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)[C@@H]1C[C@H]1c1ccccc1)N1CCSC1 Homo sapiens CHEMBL1110127 single protein format
CHEMBL217802 OBDepict O N H B HO OH O Ki = 1.7 nM 275.11 O=C(CCC(=O)N1CCC[C@H]1B(O)O)c1ccccc1 Homo sapiens CHEMBL908233 single protein format
CHEMBL2333023 OBDepict O N N H H B HO OH O N IC50 = 1.8 nM 277.09 O=C(NCC(=O)N1CCC[C@H]1B(O)O)c1cccnc1 Homo sapiens CHEMBL2346128 single protein format
CHEMBL1243373 OBDepict OH B HO H N O N H O IC50 = 1.8 nM 326.16 O=C(NCC(=O)N1CCC[C@H]1B(O)O)c1cccc2ccccc12 Homo sapiens CHEMBL2346128 single protein format
CHEMBL515482 OBDepict O N H N O O O CH 3 IC50 = 2.0 nM 394.47 CC(=O)c1cc(OCCc2ccccc2)c(=O)n2c1CC[C@H]2C(=O)N1CCCC1 Homo sapiens CHEMBL982997 assay format
CHEMBL1086968 OBDepict O N H H H H N O H S IC50 = 2.0 nM 384.55 O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)[C@@H]1C[C@H]1c1ccccc1)N1CCSC1 Homo sapiens CHEMBL982997 assay format
CHEMBL386890 OBDepict Cl Cl NH O N O H B HO OH Ki = 2.2 nM 344.99 O=C(NCC(=O)N1CCC[C@H]1B(O)O)c1cc(Cl)ccc1Cl Homo sapiens CHEMBL908233 single protein format
CHEMBL304644 OBDepict O N S H H N O S IC50 = 2.3 nM 376.55 O=C([C@@H]1CSCN1C(=O)C[C@H]1CCc2ccccc2C1)N1CCSC1 Homo sapiens CHEMBL765791 assay format
CHEMBL217244 OBDepict OH B OH H N O N H O Ki = 2.3 nM 268.12 O=C(NCC(=O)N1CCC[C@H]1B(O)O)C1CCCC1 Homo sapiens CHEMBL908233 single protein format
CHEMBL387444 OBDepict O N H N O H B HO HO Ki = 2.7 nM 282.15 O=C(NCC(=O)N1CCC[C@H]1B(O)O)C1CCCCC1 Homo sapiens CHEMBL908233 single protein format
CHEMBL387050 OBDepict O N N O H B HO OH Ki = 2.8 nM 288.11 O=C1c2ccccc2CN1CC(=O)N1CCC[C@H]1B(O)O Homo sapiens CHEMBL908233 single protein format
CHEMBL1079410 OBDepict N H N O N H CH 3 H O O IC50 = 3.0 nM 301.35 C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H]1C#N Homo sapiens CHEMBL1104942 single protein format
CHEMBL476508 OBDepict F O O N O CH 3 H N O IC50 = 3.0 nM 412.46 CC(=O)c1cc(OCCc2ccc(F)cc2)c(=O)n2c1CC[C@H]2C(=O)N1CCCC1 Homo sapiens CHEMBL982997 assay format
CHEMBL318284 OBDepict O N O H N O H O N O O Ki = 3.3 nM 517.58 O=C(c1cc(COCc2ccccc2)on1)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1 Homo sapiens CHEMBL765807 single protein format
CHEMBL65109 OBDepict O N H H N O S IC50 = 3.4 nM 358.51 O=C([C@H]1CCCN1C(=O)C[C@H]1CCc2ccccc2C1)N1CCSC1 Homo sapiens CHEMBL765791 assay format
CHEMBL4451993 OBDepict O H N O O N Ki = 3.5 nM 348.4 O=C[C@@H]1CCCN1C(=O)c1cccc2c1C(=O)N(Cc1ccccc1)C2 Homo sapiens CHEMBL4336753 single protein format
CHEMBL66257 OBDepict O N S H H N O IC50 = 4.0 nM 358.51 O=C([C@@H]1CSCN1C(=O)C[C@H]1CCc2ccccc2C1)N1CCCC1 Homo sapiens CHEMBL765791 assay format
CHEMBL476950 OBDepict F F O O N S O O H N O IC50 = 4.0 nM 514.55 O=C([C@@H]1CCc2c(S(=O)(=O)c3ccccc3)cc(OCc3cc(F)cc(F)c3)c(=O)n21)N1CCCC1 Homo sapiens CHEMBL982997 assay format
CHEMBL79993 OBDepict O H N O H N O O Ki = 4.3 nM 330.38 O=C[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1 Homo sapiens CHEMBL1176041 single protein format
CHEMBL443836 OBDepict O N N H H B OH HO O Cl Cl Ki = 4.4 nM 344.99 O=C(NCC(=O)N1CCC[C@H]1B(O)O)c1c(Cl)cccc1Cl Homo sapiens CHEMBL908233 single protein format
CHEMBL216410 OBDepict O N H H 3 C CH 3 N O H B HO HO Ki = 4.5 nM 242.08 CC(C)C(=O)NCC(=O)N1CCC[C@H]1B(O)O Homo sapiens CHEMBL908233 single protein format
CHEMBL307938 OBDepict O N H H H S N O IC50 = 4.8 nM 358.51 O=C([C@@H]1C2CCC(CC2)N1C(=O)[C@@H]1C[C@@H]1c1cccs1)N1CCCC1 Homo sapiens CHEMBL769575 single protein format
CHEMBL308073 OBDepict O N H H N O H F F F IC50 = 5.0 nM 450.55 O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCCC(c1ccccc1)C(F)(F)F)N1CCCC1 Homo sapiens CHEMBL769576 single protein format
CHEMBL2333025 OBDepict O N N H H B HO OH O N IC50 = 5.0 nM 277.09 O=C(NCC(=O)N1CCC[C@H]1B(O)O)c1ccncc1 Homo sapiens CHEMBL2346128 single protein format
CHEMBL4748328 OBDepict CH 3 O S N N H O N O H F F N IC50 = 5.0 nM 420.44 COc1ccc(Cc2nc(C(=O)NCC(=O)N3CC(F)(F)C[C@H]3C#N)cs2)cc1 Homo sapiens CHEMBL4714148 single protein format
CHEMBL63045 OBDepict O N H H N O IC50 = 5.4 nM 340.47 O=C([C@H]1CCCN1C(=O)C[C@H]1CCc2ccccc2C1)N1CCCC1 Homo sapiens CHEMBL765791 assay format
CHEMBL78877 OBDepict O N O H H 3 C H 3 C CH 3 N O IC50 = 5.5 nM 294.4 CC(C)(C)OC(=O)N1C2CCC(C2)[C@@H]1C(=O)N1CCCC1 Homo sapiens CHEMBL769576 single protein format
CHEMBL4559324 OBDepict CH 3 O N H N O O H 3 C H B O O CH 3 H H CH 3 H 3 C H Ki = 6.0 nM 440.35 COc1cc(NC(C)=O)ccc1C(=O)N1CCC[C@H]1B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1 Homo sapiens CHEMBL4316407 cell-based format
CHEMBL273161 OBDepict O N O H N O H O N O O Ki = 6.0 nM 519.6 O=C(C1=NOC(COCc2ccccc2)C1)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1 Homo sapiens CHEMBL949941 single protein format
CHEMBL2024671 OBDepict N H N O H N O IC50 = 6.0 nM 339.44 N#C[C@@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)CCCc1ccccc1 Homo sapiens CHEMBL2026781 assay format
CHEMBL66258 OBDepict O N S H N O S IC50 = 6.5 nM 362.52 O=C([C@@H]1CSCN1C(=O)CC1Cc2ccccc2C1)N1CCSC1 Homo sapiens CHEMBL765791 assay format
CHEMBL335796 OBDepict O N H N O IC50 = 7.0 nM 376.5 O=C([C@@H]1Cc2ccccc2CN1C(=O)CCCc1ccccc1)N1CCCC1 Homo sapiens CHEMBL765788 single protein format
CHEMBL477998 OBDepict O N H N O O O CH 3 F F IC50 = 7.0 nM 416.42 CC(=O)c1cc(OCc2ccc(F)c(F)c2)c(=O)n2c1CC[C@H]2C(=O)N1CCCC1 Homo sapiens CHEMBL982997 assay format
CHEMBL387050 OBDepict O N N O H B HO OH IC50 = 7.2 nM 288.11 O=C1c2ccccc2CN1CC(=O)N1CCC[C@H]1B(O)O Homo sapiens CHEMBL2346128 single protein format
CHEMBL385419 OBDepict O N N H B CH 3 HO OH O Ki = 7.4 nM 290.13 CN(CC(=O)N1CCC[C@H]1B(O)O)C(=O)c1ccccc1 Homo sapiens CHEMBL908233 single protein format
CHEMBL478199 OBDepict O N H N O O O CH 3 Cl F IC50 = 8.0 nM 432.88 CC(=O)c1cc(OCc2ccc(F)c(Cl)c2)c(=O)n2c1CC[C@H]2C(=O)N1CCCC1 Homo sapiens CHEMBL982997 assay format
CHEMBL64240 OBDepict O N H N O S IC50 = 8.7 nM 344.48 O=C([C@H]1CCCN1C(=O)CC1Cc2ccccc2C1)N1CCSC1 Homo sapiens CHEMBL765791 assay format
CHEMBL4576969 OBDepict CH 3 S N O H B O O CH 3 H H H 3 C CH 3 H Ki = 9.0 nM 399.37 CSc1ccccc1C(=O)N1CCC[C@H]1B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1 Homo sapiens CHEMBL4316407 cell-based format
CHEMBL76303 OBDepict O N H N O IC50 = 9.0 nM 372.55 O=C([C@@H]1C2CCC(CC2)N1C(=O)CCCC(C1CC1)C1CC1)N1CCCC1 Homo sapiens CHEMBL769576 single protein format
CHEMBL139862 OBDepict CH 3 N O H N O IC50 = 9.0 nM 368.52 CC1CCC(CC(=O)N2Cc3ccccc3C[C@H]2C(=O)N2CCCC2)CC1 Homo sapiens CHEMBL765788 single protein format
CHEMBL4751873 OBDepict N H N F F O N H O N S Br IC50 = 9.0 nM 469.31 N#C[C@@H]1CC(F)(F)CN1C(=O)CNC(=O)c1csc(Cc2ccccc2Br)n1 Homo sapiens CHEMBL4714148 single protein format
CHEMBL3818013 OBDepict N H N O H H O N H O Ki = 10.0 nM 365.43 N#C[C@@H]1CCCN1C(=O)[C@@H]1CC=C[C@H]2CN(OCc3ccccc3)C(=O)[C@@H]21 Homo sapiens CHEMBL3819964 assay format
CHEMBL62960 OBDepict O N S H N O IC50 = 10.0 nM 344.48 O=C([C@@H]1CSCN1C(=O)CC1Cc2ccccc2C1)N1CCCC1 Homo sapiens CHEMBL765791 assay format
CHEMBL476951 OBDepict O N H N O O S O O F F F IC50 = 11.0 nM 546.57 O=C([C@@H]1CCc2c(S(=O)(=O)c3ccccc3)cc(OCc3ccc(C(F)(F)F)cc3)c(=O)n21)N1CCCC1 Homo sapiens CHEMBL982997 assay format
CHEMBL3233847 OBDepict OH B HO H N O N H O N IC50 = 11.2 nM 327.15 O=C(NCC(=O)N1CCC[C@H]1B(O)O)c1ccnc2ccccc12 Homo sapiens CHEMBL3239282 single protein format
CHEMBL514702 OBDepict O N H N O Cl HN IC50 = 12.0 nM 371.87 O=C([C@@H]1CCc2c(Cl)cc(NCc3ccccc3)c(=O)n21)N1CCCC1 Homo sapiens CHEMBL982997 assay format
CHEMBL216376 OBDepict HO B OH H N O N H 3 C O H 3 C H 3 C Ki = 13.0 nM 256.11 CC(C)C(=O)N(C)CC(=O)N1CCC[C@H]1B(O)O Homo sapiens CHEMBL908233 single protein format
CHEMBL78421 OBDepict O N H H H N O IC50 = 14.0 nM 338.45 O=C([C@@H]1C2CCC(C2)N1C(=O)[C@@H]1C[C@@H]1c1ccccc1)N1CCCC1 Homo sapiens CHEMBL769576 single protein format
CHEMBL422281 OBDepict O N H N O IC50 = 14.0 nM 390.53 O=C([C@@H]1Cc2ccccc2CN1C(=O)CCCCc1ccccc1)N1CCCC1 Homo sapiens CHEMBL765788 single protein format
CHEMBL97152 OBDepict O N O H N O H O N O Ki = 15.0 nM 473.53 O=C(c1cc(-c2ccccc2)on1)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1 Homo sapiens CHEMBL765810 single protein format
CHEMBL476985 OBDepict O N H N O Cl NH F F IC50 = 15.0 nM 407.85 O=C([C@@H]1CCc2c(Cl)cc(NCc3ccc(F)c(F)c3)c(=O)n21)N1CCCC1 Homo sapiens CHEMBL982997 assay format
CHEMBL95698 OBDepict O N O N O O N S Ki = 16.0 nM 413.5 O=C(c1ccsn1)C1CCCN1C(=O)C1CCCN1C(=O)OCc1ccccc1 Homo sapiens CHEMBL765810 single protein format
CHEMBL269822 OBDepict O N H N O H O N S Ki = 16.0 nM 385.49 O=C(c1nccs1)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1OCc1ccccc1 Homo sapiens CHEMBL949941 single protein format
CHEMBL4792518 OBDepict H N N F F O N H O N S Cl Cl IC50 = 16.0 nM 459.31 N#C[C@@H]1CC(F)(F)CN1C(=O)CNC(=O)c1csc(Cc2cc(Cl)ccc2Cl)n1 Homo sapiens CHEMBL4714148 single protein format
CHEMBL262241 OBDepict O N H N O IC50 = 17.0 nM 326.44 O=C([C@H]1CCCN1C(=O)CC1Cc2ccccc2C1)N1CCCC1 Homo sapiens CHEMBL765791 assay format
CHEMBL77088 OBDepict O N H H N O H IC50 = 17.0 nM 386.58 O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCCC(C1CC1)C1CC1)N1CCCC1 Homo sapiens CHEMBL769576 single protein format
CHEMBL342718 OBDepict Cl CH 3 O N O H N O IC50 = 17.0 nM 440.97 Cc1cc(Cl)ccc1OCCCC(=O)N1Cc2ccccc2C[C@H]1C(=O)N1CCCC1 Homo sapiens CHEMBL765788 single protein format
CHEMBL515786 OBDepict F HN O N Cl H N O IC50 = 17.0 nM 389.86 O=C([C@@H]1CCc2c(Cl)cc(NCc3ccc(F)cc3)c(=O)n21)N1CCCC1 Homo sapiens CHEMBL982997 assay format
CHEMBL304020 OBDepict O N S H N O S IC50 = 18.0 nM 364.54 O=C([C@@H]1CSCN1C(=O)CC1CCc2sccc2C1)N1CCCC1 Homo sapiens CHEMBL765791 assay format
CHEMBL478844 OBDepict O N H N O O F F IC50 = 18.0 nM 374.39 O=C([C@@H]1CCc2ccc(OCc3ccc(F)c(F)c3)c(=O)n21)N1CCCC1 Homo sapiens CHEMBL982997 assay format
CHEMBL99305 OBDepict O N O H N O H O N O Si CH 3 CH 3 CH 3 Ki = 19.0 nM 469.61 C[Si](C)(C)c1cc(C(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)no1 Homo sapiens CHEMBL765810 single protein format
CHEMBL1079579 OBDepict N H N O HN O O IC50 = 20.0 nM 287.32 N#C[C@@H]1CCCN1C(=O)CNC(=O)OCc1ccccc1 Homo sapiens CHEMBL1104942 single protein format
CHEMBL79079 OBDepict O N H N O IC50 = 20.0 nM 384.56 O=C([C@@H]1C2CCC(CC2)N1C(=O)CCCC=C(C1CC1)C1CC1)N1CCCC1 Homo sapiens CHEMBL769576 single protein format
CHEMBL310809 OBDepict O N O H CH 3 H 3 C CH 3 N O IC50 = 20.0 nM 306.41 CC(C)(C)OC(=O)N1C2CCC(CC2)[C@@H]1C(=O)N1CC=CC1 Homo sapiens CHEMBL769576 single protein format
CHEMBL342651 OBDepict O N H N O F F F IC50 = 21.0 nM 416.44 O=C([C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(F)(F)F)cc1)N1CCCC1 Homo sapiens CHEMBL765788 single protein format
CHEMBL138674 OBDepict O O NH N O H N O IC50 = 21.0 nM 477.61 O=C(NCCCCCC(=O)N1Cc2ccccc2C[C@H]1C(=O)N1CCCC1)OCc1ccccc1 Homo sapiens CHEMBL765788 single protein format
CHEMBL516746 OBDepict F F O O N O H 3 C H N O IC50 = 22.0 nM 416.42 CC(=O)c1cc(OCc2cc(F)cc(F)c2)c(=O)n2c1CC[C@H]2C(=O)N1CCCC1 Homo sapiens CHEMBL982997 assay format
CHEMBL518279 OBDepict F O O N H N O IC50 = 22.0 nM 356.4 O=C([C@@H]1CCc2ccc(OCc3ccc(F)cc3)c(=O)n21)N1CCCC1 Homo sapiens CHEMBL982997 assay format
CHEMBL478843 OBDepict F F O O N H N O IC50 = 22.0 nM 374.39 O=C([C@@H]1CCc2ccc(OCc3cc(F)cc(F)c3)c(=O)n21)N1CCCC1 Homo sapiens CHEMBL982997 assay format
CHEMBL2159748 OBDepict N H N O O N Ki = 23.0 nM 345.4 N#C[C@@H]1CCCN1C(=O)c1cccc2c1C(=O)N(Cc1ccccc1)C2 Homo sapiens CHEMBL3819964 assay format
CHEMBL311876 OBDepict O N O H CH 3 H 3 C CH 3 N O IC50 = 23.0 nM 308.42 CC(C)(C)OC(=O)N1C2CCC(CC2)[C@@H]1C(=O)N1CCCC1 Homo sapiens CHEMBL769576 single protein format
CHEMBL139696 OBDepict O N H N O H H IC50 = 23.0 nM 374.48 O=C([C@@H]1Cc2ccccc2CN1C(=O)[C@H]1C[C@@H]1c1ccccc1)N1CCCC1 Homo sapiens CHEMBL765788 single protein format
CHEMBL80557 OBDepict O N H N O IC50 = 24.0 nM 384.56 O=C([C@@H]1C2CCC(CC2)N1C(=O)CC/C=C/C(C1CC1)C1CC1)N1CCCC1 Homo sapiens CHEMBL769576 single protein format
CHEMBL63133 OBDepict O N S H H N O S IC50 = 24.0 nM 376.55 O=C([C@@H]1CSCN1C(=O)C[C@@H]1CCc2ccccc2C1)N1CCSC1 Homo sapiens CHEMBL765791 assay format
CHEMBL311879 OBDepict O N O H CH 3 H 3 C CH 3 N O S IC50 = 24.0 nM 326.46 CC(C)(C)OC(=O)N1C2CCC(CC2)[C@@H]1C(=O)N1CCSC1 Homo sapiens CHEMBL769576 single protein format
CHEMBL217753 OBDepict O N N H H B HO OH O Ki = 25.0 nM 276.1 O=C(NCC(=O)N1CCC[C@H]1B(O)O)c1ccccc1 Homo sapiens CHEMBL908233 single protein format
CHEMBL423002 OBDepict CH 3 O N O H N O IC50 = 25.0 nM 356.47 CC(=O)CCCCC(=O)N1Cc2ccccc2C[C@H]1C(=O)N1CCCC1 Homo sapiens CHEMBL765788 single protein format
CHEMBL76679 OBDepict O N H N O IC50 = 26.0 nM 358.53 O=C([C@@H]1C2CCC(C2)N1C(=O)CCCC(C1CC1)C1CC1)N1CCCC1 Homo sapiens CHEMBL769576 single protein format
CHEMBL1173095 OBDepict O H N O H N O O IC50 = 26.0 nM 344.41 O=C[C@@H]1CCCCN1C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1 Homo sapiens CHEMBL1176041 single protein format