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Q13557 | KCC2D_HUMAN | Calcium/calmodulin-dependent protein kinase type II subunit delta (CAMK2D)

3D structures mapped by conservation among orthologs

[ Domain: "Protein kinase" // Pkinase_Tyr ]

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[ Domain: "NTF2-like" // DUF4440 ]

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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

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL4860979 OBDepict F S N O O CH 3 N H 2 N O N H IC50 = -31000.0 nM 466.54 CN(C1CC1)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3ccc4c(c3)CCNC4=O)c2)c(F)c1 Homo sapiens CHEMBL4804353 cell-based format
CHEMBL4859660 OBDepict NH 2 N F + N O NH O _ O IC50 = -5700.0 nM 378.36 Nc1ncc(-c2cccc([N+](=O)[O-])c2F)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804353 cell-based format
CHEMBL4855542 OBDepict NH 2 N S N O NH IC50 = -4100.0 nM 372.45 Nc1ncc(-c2cccc3ncsc23)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804353 cell-based format
CHEMBL388978 OBDepict CH 3 HN H H O H O N H 3 C H 3 C N O N H IC50 = 0.0311 nM 466.54 CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 Homo sapiens CHEMBL4328335 single protein format
CHEMBL4218769 OBDepict CH 3 N H 3 C H H 3 C NH O N H N CH 3 N N N S IC50 = 0.05 nM 463.61 CCN(CC)[C@@H](C)CNC(=O)c1cc(NC)nc(-c2cnn3ccc(-c4cccs4)nc23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4208018 OBDepict CH 3 N H 3 C H CH 3 HN O N N N N N H OH S IC50 = 0.06 nM 519.68 CCN(CC)[C@@H](C)CNC(=O)c1cc(-c2cnn3ccc(-c4cccs4)nc23)nc(N2CC[C@@H](O)C2)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4215817 OBDepict CH 3 N H 3 C H CH 3 HN O N N N N N H OH S IC50 = 0.07 nM 519.68 CCN(CC)[C@@H](C)CNC(=O)c1cc(-c2cnn3ccc(-c4cccs4)nc23)nc(N2CC[C@H](O)C2)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4218245 OBDepict CH 3 O NH N HN O N N N N H 3 C H CH 3 CH 3 S IC50 = 0.08 nM 507.66 CCN(CC)[C@@H](C)CNC(=O)c1cc(NCCOC)nc(-c2cnn3ccc(-c4cccs4)nc23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4217261 OBDepict CH 3 N H 3 C H H 3 C NH O N N N N S IC50 = 0.09 nM 434.57 CCN(CC)[C@@H](C)CNC(=O)c1ccnc(-c2cnn3ccc(-c4cccs4)nc23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4215300 OBDepict CH 3 O N N NH O N N N N CH 3 H H 3 C H 3 C S IC50 = 0.1 nM 519.68 CCN(CC)[C@@H](C)CNC(=O)c1cc(-c2cnn3ccc(-c4cccs4)nc23)nc(N2CC(OC)C2)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4206514 OBDepict HO NH N HN O N N N N H 3 C H CH 3 CH 3 S IC50 = 0.1 nM 493.64 CCN(CC)[C@@H](C)CNC(=O)c1cc(NCCO)nc(-c2cnn3ccc(-c4cccs4)nc23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4210359 OBDepict H 3 C N CH 3 H H 3 C N H O N N N N N HO S IC50 = 0.1 nM 505.65 CCN(CC)[C@@H](C)CNC(=O)c1cc(-c2cnn3ccc(-c4cccs4)nc23)nc(N2CC(O)C2)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4209816 OBDepict H 3 C N CH 3 H H 3 C N H O N N N N N OH S IC50 = 0.22 nM 533.7 CCN(CC)[C@@H](C)CNC(=O)c1cc(-c2cnn3ccc(-c4cccs4)nc23)nc(N2CCC(O)CC2)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4213838 OBDepict H 3 C N CH 3 H H 3 C NH O N N CH 3 H 3 C N N N S IC50 = 0.23 nM 477.64 CCN(CC)[C@@H](C)CNC(=O)c1cc(-c2cnn3ccc(-c4cccs4)nc23)nc(N(C)C)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4210881 OBDepict CH 3 O O N HN O N N N N H 3 C H CH 3 CH 3 S IC50 = 0.28 nM 508.65 CCN(CC)[C@@H](C)CNC(=O)c1cc(OCCOC)nc(-c2cnn3ccc(-c4cccs4)nc23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4205997 OBDepict H 3 C N CH 3 H H 3 C N H O N N N N N O S IC50 = 0.3 nM 519.68 CCN(CC)[C@@H](C)CNC(=O)c1cc(-c2cnn3ccc(-c4cccs4)nc23)nc(N2CCOCC2)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4209443 OBDepict CH 3 N H 3 C H H 3 C NH O N CH 3 N N N S IC50 = 0.92 nM 462.62 CCc1cc(C(=O)NC[C@H](C)N(CC)CC)cc(-c2cnn3ccc(-c4cccs4)nc23)n1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4205708 OBDepict CH 3 N CH 3 HN O N N N N S IC50 = 1.6 nM 420.54 CCN(CC)CCNC(=O)c1ccnc(-c2cnn3ccc(-c4cccs4)nc23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL3699625 OBDepict CH 3 O N H N N N N N O CH 3 NH 2 O O NH 2 IC50 = 2.0 nM 522.61 CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(N4CCC(N5CCOCC5)CC4)cc3OC)nc21 Homo sapiens CHEMBL3706051 single protein format
CHEMBL4211430 OBDepict CH 3 N CH 3 HN CH 3 H O N N N N S IC50 = 2.17 nM 434.57 CCN(CC)C[C@H](C)NC(=O)c1ccnc(-c2cnn3ccc(-c4cccs4)nc23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4213305 OBDepict H 3 C N H 3 C NH O N N N N N S IC50 = 3.3 nM 459.58 CCN(CC)CCNC(=O)c1cc(-c2cnn3ccc(-c4cccs4)nc23)c2nccn2c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4209840 OBDepict H 3 C N H N H O N N N N S IC50 = 3.4 nM 432.55 CCN1CCC[C@H]1CNC(=O)c1ccnc(-c2cnn3ccc(-c4cccs4)nc23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4210568 OBDepict CH 3 N CH 3 HN O N N N S IC50 = 3.5 nM 419.55 CCN(CC)CCNC(=O)c1cccc(-c2cnn3ccc(-c4cccs4)nc23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4208717 OBDepict H 3 C N H 3 C NH O N N CH 3 N N N S IC50 = 4.0 nM 473.61 CCN(CC)CCNC(=O)c1cc(-c2cnn3ccc(-c4cccs4)nc23)c2ncn(C)c2c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4216080 OBDepict CH 3 N CH 3 HN O N N N S IC50 = 5.8 nM 419.55 CCN(CC)CCNC(=O)c1cccc(-c2cnc3ccc(-c4cccs4)nn23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4213540 OBDepict CH 3 N H 3 C H H 3 C NH O N N N N S IC50 = 7.2 nM 434.57 CCN(CC)[C@H](C)CNC(=O)c1ccnc(-c2cnn3ccc(-c4cccs4)nc23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL3699629 OBDepict CH 3 N H 2 N N O H 2 N O N N H Cl N N IC50 = 8.0 nM 511.03 CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(N4CCC(N5CCCC5)CC4)c(Cl)c3)nc21 Homo sapiens CHEMBL3706051 single protein format
CHEMBL270849 OBDepict Cl HN N N N NH IC50 = 9.0 nM 365.87 Clc1cccc(Nc2nccc(-c3cccc(N4CCNCC4)c3)n2)c1 Homo sapiens CHEMBL933473 single protein format
CHEMBL4214345 OBDepict H 3 C N H 3 C HN O N N N N S IC50 = 9.1 nM 434.57 CCN(CC)CCCNC(=O)c1ccnc(-c2cnn3ccc(-c4cccs4)nc23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL255607 OBDepict H 2 N N O N H O N H Cl IC50 = 10.0 nM 404.86 NCCc1cn(C2=C(c3c[nH]c4ccc(Cl)cc34)C(=O)NC2=O)c2ccccc12 Homo sapiens CHEMBL950209 single protein format
CHEMBL272978 OBDepict H 2 N HN N N N H Cl IC50 = 12.0 nM 339.83 NCCNc1cccc(-c2ccnc(Nc3cccc(Cl)c3)n2)c1 Homo sapiens CHEMBL933473 single protein format
CHEMBL402340 OBDepict H 3 C N H N O N H O N H Cl IC50 = 13.0 nM 418.88 CNCCc1cn(C2=C(c3c[nH]c4ccc(Cl)cc34)C(=O)NC2=O)c2ccccc12 Homo sapiens CHEMBL950209 single protein format
CHEMBL3699624 OBDepict CH 3 O N H N N N N O CH 3 NH 2 O NH 2 IC50 = 17.0 nM 477.57 CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(C4CCN(C5CC5)CC4)cc3OC)nc21 Homo sapiens CHEMBL3706051 single protein format
CHEMBL271648 OBDepict CH 3 N H N O N H O N H O O CH 3 IC50 = 21.0 nM 442.48 CNCCc1cn(C2=C(c3c[nH]c4ccc(C(=O)OC)cc34)C(=O)NC2=O)c2ccccc12 Homo sapiens CHEMBL950209 single protein format
CHEMBL3699626 OBDepict H 3 C O N H N N N N O CH 3 NH 2 F F F O H 2 N IC50 = 22.0 nM 533.56 CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(C4CCN(CCC(F)(F)F)CC4)cc3OC)nc21 Homo sapiens CHEMBL3706051 single protein format
CHEMBL402533 OBDepict H 2 N N O N H O N H F F F IC50 = 32.0 nM 438.41 NCCc1cn(C2=C(c3c[nH]c4ccc(C(F)(F)F)cc34)C(=O)NC2=O)c2ccccc12 Homo sapiens CHEMBL950209 single protein format
CHEMBL403446 OBDepict H 2 N N O N H O N H Br IC50 = 34.0 nM 463.34 NCCCn1cc(C2=C(c3c[nH]c4ccc(Br)cc34)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL934464 single protein format
CHEMBL4215541 OBDepict CH 3 N H 3 C NH O N N N S IC50 = 37.0 nM 391.5 CN(C)CCNC(=O)c1cccc(-c2cnc3ccc(-c4cccs4)nn23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL3699630 OBDepict CH 3 N NH 2 N O NH 2 O N N H HN IC50 = 37.0 nM 379.42 CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc4c(c3)CCNC4)nc21 Homo sapiens CHEMBL3706051 single protein format
CHEMBL403337 OBDepict H 2 N N O N H O N H F IC50 = 38.0 nM 388.4 NCCc1cn(C2=C(c3c[nH]c4ccc(F)cc34)C(=O)NC2=O)c2ccccc12 Homo sapiens CHEMBL950209 single protein format
CHEMBL3699634 OBDepict CH 3 O NH N N HN N O NH 2 O H 2 N IC50 = 39.0 nM 485.55 COc1cc(C2CCNCC2)ccc1Nc1ncc2c(=O)c(C(N)=O)c(N)n(-c3ccccc3)c2n1 Homo sapiens CHEMBL3706051 single protein format
CHEMBL4211934 OBDepict H 3 C N CH 3 CH 3 CH 3 HN O N N N S IC50 = 41.0 nM 447.61 CC(C)N(CCNC(=O)c1cccc(-c2cnc3ccc(-c4cccs4)nn23)c1)C(C)C Homo sapiens CHEMBL4184342 assay format
CHEMBL271045 OBDepict Cl HN N N O OH IC50 = 42.0 nM 325.76 O=C(O)c1ccc(-c2ccnc(Nc3cccc(Cl)c3)n2)cc1 Homo sapiens CHEMBL933473 single protein format
CHEMBL4210073 OBDepict H 3 C N H 3 C NH O N N N IC50 = 44.0 nM 413.53 CCN(CC)CCNC(=O)c1cccc(-c2cnc3ccc(-c4ccccc4)nn23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL270032 OBDepict NH 2 N O N H O N H N IC50 = 46.0 nM 395.42 N#Cc1ccc2[nH]cc(C3=C(n4cc(CCN)c5ccccc54)C(=O)NC3=O)c2c1 Homo sapiens CHEMBL950209 single protein format
CHEMBL4209789 OBDepict H 3 C N H 3 C N H 3 C O N N N N S IC50 = 53.0 nM 434.57 CCN(CC)CCN(C)C(=O)c1ccnc(-c2cnn3ccc(-c4cccs4)nc23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4205405 OBDepict CH 3 N H 3 C NH O N N N N IC50 = 57.0 nM 374.45 CN(C)CCNC(=O)c1cccc(-c2cnc3ccc(-n4cccc4)nn23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL3699635 OBDepict OH N H 2 N N O NH 2 O N N H O H 3 C NH IC50 = 57.0 nM 453.5 COc1cc(C2CCNCC2)ccc1Nc1ncc2c(=O)c(C(N)=O)c(N)n(CCO)c2n1 Homo sapiens CHEMBL3706051 single protein format
CHEMBL402428 OBDepict OH O N N N H IC50 = 64.0 nM 291.31 O=C(O)c1ccc(-c2ccnc(Nc3ccccc3)n2)cc1 Homo sapiens CHEMBL933473 single protein format
CHEMBL4209139 OBDepict CH 3 N H 3 C NH O N N N S IC50 = 65.0 nM 391.5 CN(C)CCNC(=O)c1cccc(-c2cnc3ccc(-c4ccsc4)nn23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL255617 OBDepict NH 2 N N H N N O HO IC50 = 66.0 nM 307.31 Nc1cc(Nc2nccc(-c3ccc(C(=O)O)cc3)n2)ccn1 Homo sapiens CHEMBL933473 single protein format
CHEMBL430412 OBDepict NH 2 N O N H O N H IC50 = 110.0 nM 370.41 NCCc1cn(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccccc12 Homo sapiens CHEMBL950209 single protein format
CHEMBL411724 OBDepict H 3 C NH N O N H O N H CH 3 IC50 = 110.0 nM 412.49 CCc1ccc2[nH]cc(C3=C(n4cc(CCNC)c5ccccc54)C(=O)NC3=O)c2c1 Homo sapiens CHEMBL950209 single protein format
CHEMBL3699631 OBDepict CH 3 N NH 2 N O NH 2 O N N H O N H 3 C IC50 = 118.0 nM 437.5 CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(OC4CCN(C)CC4)cc3)nc21 Homo sapiens CHEMBL3706051 single protein format
CHEMBL4204410 OBDepict CH 3 N CH 3 HN CH 3 H O N N N N S IC50 = 125.0 nM 434.57 CCN(CC)C[C@@H](C)NC(=O)c1ccnc(-c2cnn3ccc(-c4cccs4)nc23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL3699627 OBDepict H 3 C CH 3 N NH 2 N O NH 2 O N N H N O IC50 = 139.0 nM 465.56 CC(C)Cn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(CCN4CCOCC4)cc3)nc21 Homo sapiens CHEMBL3706051 single protein format
CHEMBL402152 OBDepict CH 3 N H N O N H O N H IC50 = 150.0 nM 384.44 CNCCc1cn(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccccc12 Homo sapiens CHEMBL950209 single protein format
CHEMBL1939328 OBDepict H 3 C HN N N N N HN N + N N O _ O CH 3 H 3 C ClH IC50 = 154.0 nM 494.04 CCCCCNc1nc(Nc2ccc([N+](=O)[O-])cc2)nc(N2CCN(CCN(C)C)CC2)n1.Cl Homo sapiens CHEMBL1941891 single protein format
CHEMBL402524 OBDepict OH HN O N N N H N HN CH 3 H IC50 = 170.0 nM 426.48 C[C@H](Nc1cc(Nc2nccc(-c3ccc(C(=O)NO)cc3)n2)ccn1)c1ccccc1 Homo sapiens CHEMBL933473 single protein format
CHEMBL271426 OBDepict NH 2 N O N H O N H O CH 3 IC50 = 170.0 nM 400.44 COc1ccc2[nH]cc(C3=C(n4cc(CCN)c5ccccc54)C(=O)NC3=O)c2c1 Homo sapiens CHEMBL950209 single protein format
CHEMBL412302 OBDepict H 2 N N O N H O Br IC50 = 180.0 nM 424.3 NCCCn1cc(C2=C(c3cccc(Br)c3)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL934464 single protein format
CHEMBL271043 OBDepict H 3 C N H N O N H O N H O H 2 N IC50 = 190.0 nM 427.46 CNCCc1cn(C2=C(c3c[nH]c4ccc(C(N)=O)cc34)C(=O)NC2=O)c2ccccc12 Homo sapiens CHEMBL950209 single protein format
CHEMBL270141 OBDepict NH 2 N O N H O N H IC50 = 190.0 nM 384.44 NCCCc1cn(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccccc12 Homo sapiens CHEMBL950209 single protein format
CHEMBL4218994 OBDepict O N H N N N N S IC50 = 191.0 nM 417.54 O=C(NCCN1CCCC1)c1cccc(-c2cnc3ccc(-c4cccs4)nn23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL403766 OBDepict HO O N N N H N HN CH 3 H IC50 = 210.0 nM 411.47 C[C@H](Nc1cc(Nc2nccc(-c3ccc(C(=O)O)cc3)n2)ccn1)c1ccccc1 Homo sapiens CHEMBL933473 single protein format
CHEMBL403054 OBDepict Cl HN N N N O IC50 = 240.0 nM 366.85 Clc1cccc(Nc2nccc(-c3cccc(N4CCOCC4)c3)n2)c1 Homo sapiens CHEMBL933473 single protein format
CHEMBL4214991 OBDepict H 3 C N CH 3 HN O N N N IC50 = 245.0 nM 385.47 CN(C)CCNC(=O)c1cccc(-c2cnc3ccc(-c4ccccc4)nn23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4215635 OBDepict H 3 C N H 3 C NH O N N N N N S IC50 = 254.0 nM 459.58 CCN(CC)CCNC(=O)c1cc(-c2cnn3ccc(-c4cccs4)nc23)n2ccnc2c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL3699623 OBDepict CH 3 N NH 2 N O NH 2 O N N H N O N CH 3 IC50 = 260.0 nM 450.5 CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(C(=O)N4CCN(C)CC4)cc3)nc21 Homo sapiens CHEMBL3706051 single protein format
CHEMBL3699632 OBDepict CH 3 N NH 2 N O NH 2 O N N H N CH 3 CH 3 IC50 = 268.0 nM 381.44 CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3cccc(CN(C)C)c3)nc21 Homo sapiens CHEMBL3706051 single protein format
CHEMBL408434 OBDepict H 2 N N O N H O CH 3 IC50 = 280.0 nM 359.43 Cc1cccc(C2=C(c3cn(CCCN)c4ccccc34)C(=O)NC2=O)c1 Homo sapiens CHEMBL934464 single protein format
CHEMBL256460 OBDepict CH 3 N H N O N H O N H HN O CH 3 IC50 = 280.0 nM 441.49 CNCCc1cn(C2=C(c3c[nH]c4ccc(C(=O)NC)cc34)C(=O)NC2=O)c2ccccc12 Homo sapiens CHEMBL950209 single protein format
CHEMBL411253 OBDepict H 2 N N O N H O IC50 = 290.0 nM 395.46 NCCCn1cc(C2=C(c3cccc4ccccc34)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL934464 single protein format
CHEMBL255633 OBDepict OH HN O N N HN IC50 = 290.0 nM 306.33 O=C(NO)c1ccc(-c2ccnc(Nc3ccccc3)n2)cc1 Homo sapiens CHEMBL933473 single protein format
CHEMBL409856 OBDepict O N H O N N H 3 C N H IC50 = 300.0 nM 424.5 Cn1cc(C2=C(c3cn(C4CCCNC4)c4ccccc34)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL950203 single protein format
CHEMBL269264 OBDepict NH 2 N O N H O N CH 3 IC50 = 310.0 nM 398.47 Cn1cc(C2=C(c3cn(CCCN)c4ccccc34)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL934464 single protein format
CHEMBL4207271 OBDepict O NH N N N N HN S IC50 = 325.0 nM 432.55 O=C(NCCN1CCNCC1)c1cccc(-c2cnc3ccc(-c4cccs4)nn23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL256827 OBDepict NH 2 N O N H O IC50 = 350.0 nM 345.4 NCCCn1cc(C2=C(c3ccccc3)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL950207 single protein format
CHEMBL258290 OBDepict H 2 N N O N H O S IC50 = 360.0 nM 401.49 NCCCn1cc(C2=C(c3csc4ccccc34)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL934464 single protein format
CHEMBL271254 OBDepict H 3 C N H N O N H O N H O HO IC50 = 380.0 nM 428.45 CNCCc1cn(C2=C(c3c[nH]c4ccc(C(=O)O)cc34)C(=O)NC2=O)c2ccccc12 Homo sapiens CHEMBL950209 single protein format
CHEMBL271902 OBDepict NH 2 N N O N H O N H IC50 = 380.0 nM 385.43 NCCCn1nc(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL950209 single protein format
CHEMBL270875 OBDepict NH 2 N O N H O N H IC50 = 380.0 nM 384.44 NCCCn1cc(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL934464 single protein format
CHEMBL256632 OBDepict OH O N N N H N IC50 = 390.0 nM 292.3 O=C(O)c1ccc(-c2ccnc(Nc3ccncc3)n2)cc1 Homo sapiens CHEMBL933473 single protein format
CHEMBL3699633 OBDepict CH 3 N H N N N N N O CH 3 NH 2 O NH 2 IC50 = 396.0 nM 476.59 CCc1cc(N2CCN(C3CC3)CC2)ccc1Nc1ncc2c(=O)c(C(N)=O)c(N)n(CC)c2n1 Homo sapiens CHEMBL3706051 single protein format
CHEMBL1939327 OBDepict H 3 C HN N N HN N N N Cl N CH 3 H 3 C ClH IC50 = 401.0 nM 483.49 CCCCCNc1nc(Nc2ccc(Cl)cc2)nc(N2CCN(CCN(C)C)CC2)n1.Cl Homo sapiens CHEMBL1941891 single protein format
CHEMBL404077 OBDepict NH 2 OH N O N H O IC50 = 450.0 nM 361.4 NCC(O)Cn1cc(C2=C(c3ccccc3)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL950203 single protein format
CHEMBL4211112 OBDepict HO NH O N N N S IC50 = 454.0 nM 364.43 O=C(NCCO)c1cccc(-c2cnc3ccc(-c4cccs4)nn23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL4205811 OBDepict O NH N N N N O S IC50 = 474.0 nM 433.54 O=C(NCCN1CCOCC1)c1cccc(-c2cnc3ccc(-c4cccs4)nn23)c1 Homo sapiens CHEMBL4184342 assay format
CHEMBL409834 OBDepict H 2 N N O N H O IC50 = 500.0 nM 395.46 NCCCn1cc(C2=C(c3ccc4ccccc4c3)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL934464 single protein format
CHEMBL407464 OBDepict H 2 N N O N H O N IC50 = 540.0 nM 346.39 NCCCn1cc(C2=C(c3cccnc3)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL934464 single protein format
CHEMBL256872 OBDepict CH 3 N CH 3 N O N H O N H IC50 = 560.0 nM 398.47 CN(C)CCc1cn(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccccc12 Homo sapiens CHEMBL950209 single protein format
CHEMBL1939163 OBDepict CH 3 N CH 3 N H N NH N Cl Cl ClH IC50 = 619.0 nM 466.84 CN(C)C1CCC(Nc2nc(Nc3cc(Cl)cc(Cl)c3)nc3ccccc23)CC1.Cl Homo sapiens CHEMBL1941891 single protein format
CHEMBL402775 OBDepict H 2 N N O N H O N IC50 = 630.0 nM 396.45 NCCCn1cc(C2=C(c3ccnc4ccccc34)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL934464 single protein format
CHEMBL55788 OBDepict O N H O N N CH 3 NH IC50 = 640.0 nM 424.5 Cn1cc(C2=C(c3cn(C4CCNCC4)c4ccccc34)C(=O)NC2=O)c2ccccc21 Homo sapiens CHEMBL950203 single protein format
CHEMBL273008 OBDepict Cl HN N N NH 2 IC50 = 660.0 nM 296.76 Nc1cccc(-c2ccnc(Nc3cccc(Cl)c3)n2)c1 Homo sapiens CHEMBL933473 single protein format
CHEMBL3699628 OBDepict CH 3 N H 3 C N H N N N O H 2 N F F F O NH 2 IC50 = 663.0 nM 435.41 CN(C)Cc1ccc(Nc2ncc3c(=O)c(C(N)=O)c(N)n(CC(F)(F)F)c3n2)cc1 Homo sapiens CHEMBL3706051 single protein format
CHEMBL270846 OBDepict O NH N O N H HN IC50 = 680.0 nM 410.48 O=C1NC(=O)C(n2cc(C3CCNCC3)c3ccccc32)=C1c1c[nH]c2ccccc12 Homo sapiens CHEMBL950209 single protein format
CHEMBL3800585 OBDepict H 3 C N CH 3 O N N N H 2 N N N H 3 C N N H H H 3 C IC50 = 690.0 nM 471.57 C[C@H]1CN(c2cccc3nc(-c4nc(-c5cc(C(=O)N(C)C)ccn5)cnc4N)n(C)c23)CCN1 Homo sapiens CHEMBL3803174 single protein format
CHEMBL402741 OBDepict CH 3 N H O N N HN N N H H 3 C H IC50 = 720.0 nM 424.51 CNC(=O)c1ccc(-c2ccnc(Nc3ccnc(N[C@@H](C)c4ccccc4)c3)n2)cc1 Homo sapiens CHEMBL933473 single protein format
CHEMBL401681 OBDepict NH 2 N CH 3 O N H O N H IC50 = 740.0 nM 398.47 Cc1c(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccccc2n1CCCN Homo sapiens CHEMBL950209 single protein format