HOME LIGAND hPROTEOME OTHERS DOCUMENT

Q13393 | PLD1_HUMAN | Phospholipase D1 (PLD1)

3D structures mapped by conservation among orthologs



[ 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
CHEMBL4453586 OBDepict F H NH O N N H CH 3 H O N H IC50 = 1.0 nM 448.54 C[C@@H](CN1CCC2(CC1)C(=O)NC[C@H]2c1ccc(F)cc1)NC(=O)c1cc2ccccc2[nH]1 Homo sapiens CHEMBL4329649 cell-based format
CHEMBL2304616 OBDepict O N H H N N O N H Cl IC50 = 2.0 nM 438.96 O=C(NCCN1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1)C1C[C@@H]1c1ccccc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL493521 OBDepict F N N H O N HN CH 3 H O IC50 = 2.0 nM 446.53 C[C@@H](CN1CCC(n2c(=O)[nH]c3ccc(F)cc32)CC1)NC(=O)c1ccc2ccccc2c1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL492561 OBDepict Cl N H O N N O N H Br IC50 = 3.0 nM 477.79 O=C(NCCN1CCC(n2c(=O)[nH]c3cc(Br)ccc32)CC1)c1ccc(Cl)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL492558 OBDepict Cl N N H O N N H CH 3 H O F F IC50 = 3.0 nM 448.9 C[C@@H](CN1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1)NC(=O)c1ccc(F)c(F)c1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL492559 OBDepict Br N N H O N N H CH 3 H O F F IC50 = 3.5 nM 493.35 C[C@@H](CN1CCC(n2c(=O)[nH]c3cc(Br)ccc32)CC1)NC(=O)c1ccc(F)c(F)c1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL524182 OBDepict O N H H H H 3 C H N N O N H Br IC50 = 3.7 nM 497.44 C[C@@H](CN1CCC(n2c(=O)[nH]c3cc(Br)ccc32)CC1)NC(=O)[C@@H]1C[C@H]1c1ccccc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL3947795 OBDepict O N H H H H 3 C H N N O N H Br IC50 = 3.7 nM 497.44 C[C@@H](CN1CCC(n2c(=O)[nH]c3cc(Br)ccc32)CC1)NC(=O)[C@@H]1C[C@@H]1c1ccccc1 Homo sapiens CHEMBL3889074 cell-based format
CHEMBL492972 OBDepict F N N H O N N H O F F IC50 = 4.0 nM 418.42 O=C(NCCN1CCC(n2c(=O)[nH]c3ccc(F)cc32)CC1)c1ccc(F)c(F)c1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL523011 OBDepict Cl N H O H 3 C H N N O N H Br IC50 = 4.0 nM 491.82 C[C@@H](CN1CCC(n2c(=O)[nH]c3cc(Br)ccc32)CC1)NC(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL493010 OBDepict F N N H O N HN O IC50 = 4.0 nM 432.5 O=C(NCCN1CCC(n2c(=O)[nH]c3cc(F)ccc32)CC1)c1ccc2ccccc2c1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL521990 OBDepict F N H O N N O N H Br IC50 = 4.0 nM 461.34 O=C(NCCN1CCC(n2c(=O)[nH]c3cc(Br)ccc32)CC1)c1ccc(F)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL492704 OBDepict Br N N H O N HN CH 3 H O IC50 = 5.5 nM 507.43 C[C@@H](CN1CCC(n2c(=O)[nH]c3cc(Br)ccc32)CC1)NC(=O)c1ccc2ccccc2c1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL3357311 OBDepict H 3 C N N H O N N O N H H IC50 = 6.0 nM 431.54 CC(CNC(=O)c1cc2ccccc2[nH]1)N1CCC2(CC1)C(=O)NCN2c1ccccc1 Homo sapiens CHEMBL3379086 cell-based format
CHEMBL4446255 OBDepict Br N H O H 3 C H N N O NH F IC50 = 6.0 nM 489.39 C[C@@H](CN1CCC2(CC1)C(=O)NCN2c1cccc(F)c1)NC(=O)c1ccc(Br)cc1 Homo sapiens CHEMBL4329645 single protein format
CHEMBL494145 OBDepict Cl N H O CH 3 H N N O N H Cl IC50 = 6.4 nM 447.37 C[C@@H](CN1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1)NC(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL492971 OBDepict Cl N H O N N O N H F IC50 = 7.0 nM 416.88 O=C(NCCN1CCC(n2c(=O)[nH]c3ccc(F)cc32)CC1)c1ccc(Cl)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL522488 OBDepict Cl N H O H 3 C H N N O N H F IC50 = 7.4 nM 430.91 C[C@@H](CN1CCC(n2c(=O)[nH]c3cc(F)ccc32)CC1)NC(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL521677 OBDepict O N H H H H 3 C H N N O N H Cl IC50 = 8.0 nM 452.99 C[C@@H](CN1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1)NC(=O)[C@@H]1C[C@H]1c1ccccc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL246032 OBDepict O N H N N N O N H IC50 = 8.0 nM 415.5 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1cnc2ccccc2c1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL398567 OBDepict F N H N H O N N O N H IC50 = 9.5 nM 421.48 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1cc2cc(F)ccc2[nH]1 Homo sapiens CHEMBL1220784 single protein format
CHEMBL1254495 OBDepict F N HN O N N H CH 3 H O IC50 = 10.0 nM 460.55 C[C@@H](CN1CCC2(CC1)C(=O)NCN2c1cccc(F)c1)NC(=O)c1ccc2ccccc2c1 Homo sapiens CHEMBL1250950 cell-based format
CHEMBL492589 OBDepict F N H O H 3 C H N N O N H Cl IC50 = 10.0 nM 430.91 C[C@@H](CN1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1)NC(=O)c1ccc(F)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL494183 OBDepict CH 3 N H O N N O N H Cl IC50 = 10.0 nM 412.92 Cc1ccc(C(=O)NCCN2CCC(n3c(=O)[nH]c4cc(Cl)ccc43)CC2)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL492588 OBDepict F N H O CH 3 H N N O N H F IC50 = 11.0 nM 414.46 C[C@@H](CN1CCC(n2c(=O)[nH]c3cc(F)ccc32)CC1)NC(=O)c1ccc(F)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL492369 OBDepict F N H O N N O N H F IC50 = 12.0 nM 400.43 O=C(NCCN1CCC(n2c(=O)[nH]c3cc(F)ccc32)CC1)c1ccc(F)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL493736 OBDepict O N H H H H 3 C H N N O N H F IC50 = 12.0 nM 436.53 C[C@@H](CN1CCC(n2c(=O)[nH]c3ccc(F)cc32)CC1)NC(=O)[C@@H]1C[C@H]1c1ccccc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL4514153 OBDepict F H HN O N N H CH 3 H O IC50 = 16.0 nM 433.53 C[C@@H](CN1CCC2(CC1)C(=O)NC[C@H]2c1ccc(F)cc1)NC(=O)C#Cc1ccccc1 Homo sapiens CHEMBL4329649 cell-based format
CHEMBL4448918 OBDepict F H NH O N N H CH 3 H O N H IC50 = 16.0 nM 448.54 C[C@@H](CN1CCC2(CC1)C(=O)NC[C@@H]2c1ccc(F)cc1)NC(=O)c1cc2ccccc2[nH]1 Homo sapiens CHEMBL4329649 cell-based format
CHEMBL3357312 OBDepict CH 3 N N H O N O HN F F IC50 = 17.0 nM 428.48 CC(CNC(=O)c1ccc(F)c(F)c1)N1CCC2(CC1)C(=O)NCN2c1ccccc1 Homo sapiens CHEMBL3379086 cell-based format
CHEMBL3357310 OBDepict F N H N H O N H 3 C N O NH IC50 = 18.0 nM 449.53 CC(CNC(=O)c1cc2cc(F)ccc2[nH]1)N1CCC2(CC1)C(=O)NCN2c1ccccc1 Homo sapiens CHEMBL3379086 cell-based format
CHEMBL523162 OBDepict Cl N H O N N O N H F IC50 = 18.0 nM 416.88 O=C(NCCN1CCC(n2c(=O)[nH]c3cc(F)ccc32)CC1)c1ccc(Cl)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL2325482 OBDepict F N H O H 3 C H N N O NH F IC50 = 20.0 nM 428.48 C[C@@H](CN1CCC2(CC1)C(=O)NCN2c1cccc(F)c1)NC(=O)c1ccc(F)cc1 Homo sapiens CHEMBL2330403 cell-based format
CHEMBL245621 OBDepict F N H O N N O N H Cl IC50 = 21.0 nM 416.88 O=C(NCCN1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1)c1ccc(F)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL492797 OBDepict O N H N N O N H IC50 = 21.0 nM 414.51 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1ccc2ccccc2c1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL3357315 OBDepict F N N O N N H H O F F IC50 = 21.0 nM 418.42 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)C(F)C1)c1ccc(F)c(F)c1 Homo sapiens CHEMBL3379085 cell-based format
CHEMBL4475943 OBDepict F H NH O N N H O N H IC50 = 21.0 nM 434.52 O=C(NCCN1CCC2(CC1)C(=O)NC[C@H]2c1ccc(F)cc1)c1cc2ccccc2[nH]1 Homo sapiens CHEMBL4329649 cell-based format
CHEMBL4570440 OBDepict F H NH O N N H H 3 C H O N IC50 = 25.0 nM 460.55 C[C@@H](CN1CCC2(CC1)C(=O)NC[C@H]2c1ccc(F)cc1)NC(=O)c1cnc2ccccc2c1 Homo sapiens CHEMBL4329649 cell-based format
CHEMBL471056 OBDepict O N H CH 3 H N N O HN IC50 = 25.0 nM 442.56 C[C@@H](CN1CCC2(CC1)C(=O)NCN2c1ccccc1)NC(=O)c1ccc2ccccc2c1 Homo sapiens CHEMBL998623 cell-based format
CHEMBL524008 OBDepict O N N H N N H O H H IC50 = 35.0 nM 404.51 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)[C@@H]1C[C@H]1c1ccccc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL492379 OBDepict O N H H 3 C H F N F N O N H F IC50 = 38.0 nM 432.45 C[C@@H](CN1CCC(n2c(=O)[nH]c3c(F)cccc32)CC1)NC(=O)c1ccc(F)c(F)c1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL494007 OBDepict O N H N N O N H IC50 = 40.0 nM 388.47 O=C(C#Cc1ccccc1)NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL495349 OBDepict Cl N H O CH 3 H N N O N H F IC50 = 43.0 nM 430.91 C[C@@H](CN1CCC(n2c(=O)[nH]c3c(F)cccc32)CC1)NC(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL492572 OBDepict Cl N N H O N HN CH 3 H O IC50 = 46.0 nM 462.98 C[C@@H](CN1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1)NC(=O)c1ccc2ccccc2c1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL1213069 OBDepict O N H Cl N Cl N OH N IC50 = 46.0 nM 433.34 O=C(NCCN1CCC(n2c(O)nc3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 Homo sapiens CHEMBL1220784 single protein format
CHEMBL1213100 OBDepict F N O O N F N O N H IC50 = 48.0 nM 504.54 O=C(c1ccc(F)cc1)N(CCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)C(=O)c1ccc(F)cc1 Homo sapiens CHEMBL1220777 cell-based format
CHEMBL2325485 OBDepict Br NH O H 3 C H N N O NH CH 3 IC50 = 48.0 nM 485.43 Cc1cccc(N2CNC(=O)C23CCN(C[C@H](C)NC(=O)c2ccc(Br)cc2)CC3)c1 Homo sapiens CHEMBL2330326 single protein format
CHEMBL1213097 OBDepict Cl N H O N N OH N IC50 = 55.0 nM 398.89 O=C(NCCN1CCC(n2c(O)nc3ccccc32)CC1)c1ccc(Cl)cc1 Homo sapiens CHEMBL1220784 single protein format
CHEMBL1213144 OBDepict H 3 C O O CH 3 O N H O CH 3 N N O N H IC50 = 59.0 nM 454.53 COc1cc(C(=O)NCCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)cc(OC)c1OC Homo sapiens CHEMBL1220784 single protein format
CHEMBL3357307 OBDepict CH 3 N N H O N O HN IC50 = 64.0 nM 442.56 CC(CNC(=O)c1ccc2ccccc2c1)N1CCC2(CC1)C(=O)NCN2c1ccccc1 Homo sapiens CHEMBL3379086 cell-based format
CHEMBL492380 OBDepict O N H CH 3 H N N O N H F IC50 = 66.0 nM 446.53 C[C@@H](CN1CCC(n2c(=O)[nH]c3c(F)cccc32)CC1)NC(=O)c1ccc2ccccc2c1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL494008 OBDepict O N H N N N O N H IC50 = 70.0 nM 415.5 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1ccc2ncccc2c1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL3357320 OBDepict O N H N H N N O N H IC50 = 72.0 nM 429.52 O=C(NCCN1CC2CC(n3c(=O)[nH]c4ccccc43)CC2C1)c1cc2ccccc2[nH]1 Homo sapiens CHEMBL3379085 cell-based format
CHEMBL3925473 OBDepict F HN O N N H O IC50 = 73.0 nM 445.54 O=C(NCCN1CCC2(CC1)C(=O)NCC2c1ccc(F)cc1)c1ccc2ccccc2c1 Homo sapiens CHEMBL3887242 cell-based format
CHEMBL2325486 OBDepict Br N H O H 3 C H N N O NH F IC50 = 75.0 nM 489.39 C[C@H](CN1CCC2(CC1)C(=O)NCN2c1cccc(F)c1)NC(=O)c1ccc(Br)cc1 Homo sapiens CHEMBL2330403 cell-based format
CHEMBL1213066 OBDepict O N H O Br Br N N O N H IC50 = 79.0 nM 512.2 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1cc(Br)c(Br)o1 Homo sapiens CHEMBL1220784 single protein format
CHEMBL2325487 OBDepict F N HN O N N H CH 3 H O F F IC50 = 86.0 nM 446.47 C[C@@H](CN1CCC2(CC1)C(=O)NCN2c1cccc(F)c1)NC(=O)c1ccc(F)c(F)c1 Homo sapiens CHEMBL2330403 cell-based format
CHEMBL494587 OBDepict F N H N O N N H H 3 C H O H H IC50 = 100.0 nM 436.53 C[C@@H](CN1CCC(n2c(=O)[nH]c3c(F)cccc32)CC1)NC(=O)[C@@H]1C[C@H]1c1ccccc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL398568 OBDepict O N H S N N O N H IC50 = 100.0 nM 420.54 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1cc2ccccc2s1 Homo sapiens CHEMBL1220784 single protein format
CHEMBL3902347 OBDepict F H NH O N N H H 3 C H O N IC50 = 100.0 nM 460.55 C[C@@H](CN1CCC2(CC1)C(=O)NC[C@@H]2c1ccc(F)cc1)NC(=O)c1cnc2ccccc2c1 Homo sapiens CHEMBL3887242 cell-based format
CHEMBL494842 OBDepict O N H N N O N H IC50 = 110.0 nM 416.53 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)C1=CCc2ccccc2C1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL3357322 OBDepict O N N H N N H O H H IC50 = 115.0 nM 430.55 O=C(NCCN1CC2CC(n3c(=O)[nH]c4ccccc43)CC2C1)[C@@H]1C[C@H]1c1ccccc1 Homo sapiens CHEMBL3379086 cell-based format
CHEMBL3357314 OBDepict CH 3 N N N H O N H O H H IC50 = 115.0 nM 418.54 CC1CC(n2c(=O)[nH]c3ccccc32)CCN1CCNC(=O)[C@@H]1C[C@H]1c1ccccc1 Homo sapiens CHEMBL3379085 cell-based format
CHEMBL3357309 OBDepict Br N H O N CH 3 N O N H IC50 = 120.0 nM 471.4 CC(CNC(=O)c1ccc(Br)cc1)N1CCC2(CC1)C(=O)NCN2c1ccccc1 Homo sapiens CHEMBL3379086 cell-based format
CHEMBL495018 OBDepict F N H O N N O N H IC50 = 120.0 nM 432.5 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1ccc2cc(F)ccc2c1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL523496 OBDepict F N H O H 3 C H N N O N H F IC50 = 130.0 nM 414.46 C[C@@H](CN1CCC(n2c(=O)[nH]c3c(F)cccc32)CC1)NC(=O)c1ccc(F)cc1 Homo sapiens CHEMBL957604 cell-based format
CHEMBL471257 OBDepict O N H S N N O NH IC50 = 150.0 nM 434.57 O=C(NCCN1CCC2(CC1)C(=O)NCN2c1ccccc1)c1cc2ccccc2s1 Homo sapiens CHEMBL998623 cell-based format
CHEMBL511648 OBDepict O NH N N N H CH 3 H O F F IC50 = 150.0 nM 428.48 C[C@@H](CN1CCC2(CC1)C(=O)NCN2c1ccccc1)NC(=O)c1ccc(F)c(F)c1 Homo sapiens CHEMBL998623 cell-based format
CHEMBL1254736 OBDepict F N NH O N N H O N H F IC50 = 210.0 nM 453.49 O=C(NCCN1CCC2(CC1)C(=O)NCN2c1cccc(F)c1)c1cc2cc(F)ccc2[nH]1 Homo sapiens CHEMBL1250950 cell-based format
CHEMBL3357319 OBDepict F N H N H O N N O N H IC50 = 230.0 nM 447.51 O=C(NCCN1CC2CC(n3c(=O)[nH]c4ccccc43)CC2C1)c1cc2cc(F)ccc2[nH]1 Homo sapiens CHEMBL3379085 cell-based format
CHEMBL3357316 OBDepict O N H N N O N H IC50 = 244.0 nM 440.55 O=C(NCCN1CC2CC(n3c(=O)[nH]c4ccccc43)CC2C1)c1ccc2ccccc2c1 Homo sapiens CHEMBL3379085 cell-based format
CHEMBL4581260 OBDepict F N H O H 3 C H N O NH H F IC50 = 250.0 nM 427.5 C[C@@H](CN1CCC2(CC1)C(=O)NC[C@H]2c1ccc(F)cc1)NC(=O)c1ccc(F)cc1 Homo sapiens CHEMBL4329649 cell-based format
CHEMBL1254908 OBDepict F N H N H O N N O NH Cl IC50 = 250.0 nM 469.95 O=C(NCCN1CCC2(CC1)C(=O)NCN2c1cccc(Cl)c1)c1cc2cc(F)ccc2[nH]1 Homo sapiens CHEMBL1250950 cell-based format
CHEMBL1213068 OBDepict O NH N O N HO N IC50 = 260.0 nM 466.54 O=C(NCCN1CCC(n2c(O)nc3ccccc32)CC1)c1cccc2c1-c1ccccc1C2=O Homo sapiens CHEMBL1220784 single protein format
CHEMBL1253900 OBDepict F N NH O N N H O N H F IC50 = 290.0 nM 453.49 O=C(NCCN1CCC2(CC1)C(=O)NCN2c1ccc(F)cc1)c1cc2cc(F)ccc2[nH]1 Homo sapiens CHEMBL1250950 cell-based format
CHEMBL3357308 OBDepict F N H O N CH 3 N O N H IC50 = 290.0 nM 410.49 CC(CNC(=O)c1ccc(F)cc1)N1CCC2(CC1)C(=O)NCN2c1ccccc1 Homo sapiens CHEMBL3379086 cell-based format
CHEMBL1213099 OBDepict O N NH N N O N H IC50 = 300.0 nM 453.55 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)n1c2ccccc2c2ccccc21 Homo sapiens CHEMBL1220784 single protein format
CHEMBL1213143 OBDepict O N H N H N N O N H IC50 = 316.0 nM 353.43 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1ccc[nH]1 Homo sapiens CHEMBL1220784 single protein format
CHEMBL4591820 OBDepict F H HN O N N H CH 3 H O IC50 = 320.0 nM 433.53 C[C@@H](CN1CCC2(CC1)C(=O)NC[C@@H]2c1ccc(F)cc1)NC(=O)C#Cc1ccccc1 Homo sapiens CHEMBL4329649 cell-based format
CHEMBL4436548 OBDepict F H NH O N N H O N H IC50 = 320.0 nM 434.52 O=C(NCCN1CCC2(CC1)C(=O)NC[C@@H]2c1ccc(F)cc1)c1cc2ccccc2[nH]1 Homo sapiens CHEMBL4329649 cell-based format
CHEMBL1254081 OBDepict Cl N NH O N N H O N H F IC50 = 335.0 nM 469.95 O=C(NCCN1CCC2(CC1)C(=O)NCN2c1ccc(Cl)cc1)c1cc2cc(F)ccc2[nH]1 Homo sapiens CHEMBL1250950 cell-based format
CHEMBL1213141 OBDepict O HN O N N O N H IC50 = 360.0 nM 354.41 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1ccco1 Homo sapiens CHEMBL1220784 single protein format
CHEMBL1213192 OBDepict O N H S N N O N H IC50 = 380.0 nM 410.54 O=C(CSc1ccccc1)NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1 Homo sapiens CHEMBL1220777 cell-based format
CHEMBL1255081 OBDepict F N H N H O N N O NH F F IC50 = 390.0 nM 471.48 O=C(NCCN1CCC2(CC1)C(=O)NCN2c1ccc(F)c(F)c1)c1cc2cc(F)ccc2[nH]1 Homo sapiens CHEMBL1250950 cell-based format
CHEMBL1213190 OBDepict Cl Cl N H O N N O N H IC50 = 400.0 nM 433.34 O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1cc(Cl)cc(Cl)c1 Homo sapiens CHEMBL1220784 single protein format
CHEMBL4109224 OBDepict F H NH O N N H O N IC50 = 450.0 nM 446.53 O=C(NCCN1CCC2(CC1)C(=O)NC[C@@H]2c1ccc(F)cc1)c1cnc2ccccc2c1 Homo sapiens CHEMBL3887242 cell-based format
CHEMBL3357318 OBDepict Br NH O N N O N H IC50 = 468.0 nM 469.38 O=C(NCCN1CC2CC(n3c(=O)[nH]c4ccccc43)CC2C1)c1ccc(Br)cc1 Homo sapiens CHEMBL3379085 cell-based format
CHEMBL1213067 OBDepict O N H F N F N OH N IC50 = 480.0 nM 400.43 O=C(NCCN1CCC(n2c(O)nc3ccccc32)CC1)c1ccc(F)c(F)c1 Homo sapiens CHEMBL1220784 single protein format
CHEMBL4109788 OBDepict F N H O N O N H H F IC50 = 480.0 nM 413.47 O=C(NCCN1CCC2(CC1)C(=O)NC[C@@H]2c1ccc(F)cc1)c1ccc(F)cc1 Homo sapiens CHEMBL3887242 cell-based format
CHEMBL1213142 OBDepict CH 2 N H O N N O N H IC50 = 540.0 nM 390.49 C=Cc1ccc(C(=O)NCCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)cc1 Homo sapiens CHEMBL1220784 single protein format
CHEMBL3357313 OBDepict F N H O N H 3 C N O N H IC50 = 636.0 nM 396.47 CC1CC(n2c(=O)[nH]c3ccccc32)CCN1CCNC(=O)c1ccc(F)cc1 Homo sapiens CHEMBL3379085 cell-based format
CHEMBL2325483 OBDepict F N H O H 3 C H N N O NH F IC50 = 760.0 nM 428.48 C[C@H](CN1CCC2(CC1)C(=O)NCN2c1cccc(F)c1)NC(=O)c1ccc(F)cc1 Homo sapiens CHEMBL2330403 cell-based format
CHEMBL1213140 OBDepict H 3 C N H O N N OH N IC50 = 780.0 nM 378.48 Cc1ccc(C(=O)NCCN2CCC(n3c(O)nc4ccccc43)CC2)cc1 Homo sapiens CHEMBL1220784 single protein format
CHEMBL4594070 OBDepict F H NH O N N H H 3 C H O IC50 = 820.0 nM 459.57 C[C@@H](CN1CCC2(CC1)C(=O)NC[C@H]2c1ccc(F)cc1)NC(=O)c1ccc2ccccc2c1 Homo sapiens CHEMBL4329649 cell-based format
CHEMBL3357321 OBDepict O N H F N F N O N H IC50 = 820.0 nM 426.47 O=C(NCCN1CC2CC(n3c(=O)[nH]c4ccccc43)CC2C1)c1ccc(F)c(F)c1 Homo sapiens CHEMBL3379085 cell-based format
CHEMBL1213191 OBDepict Cl N N H O N HN O Cl IC50 = 870.0 nM 433.34 O=C(NCCN1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1)c1ccccc1Cl Homo sapiens CHEMBL1220777 cell-based format
CHEMBL1254822 OBDepict Cl N NH O N N H O N IC50 = 870.0 nM 463.97 O=C(NCCN1CCC2(CC1)C(=O)NCN2c1cccc(Cl)c1)c1cnc2ccccc2c1 Homo sapiens CHEMBL1250950 cell-based format
CHEMBL3357317 OBDepict F NH O N N O N H IC50 = 870.0 nM 408.48 O=C(NCCN1CC2CC(n3c(=O)[nH]c4ccccc43)CC2C1)c1ccc(F)cc1 Homo sapiens CHEMBL3379085 cell-based format
CHEMBL511475 OBDepict O N H N N O HN IC50 = 1000.0 nM 428.54 O=C(NCCN1CCC2(CC1)C(=O)NCN2c1ccccc1)c1ccc2ccccc2c1 Homo sapiens CHEMBL998623 cell-based format
CHEMBL1213098 OBDepict CH 3 O N H O N N O N H IC50 = 1000.0 nM 394.48 COc1ccc(C(=O)NCCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)cc1 Homo sapiens CHEMBL1220777 cell-based format