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Q02224 | CENPE_HUMAN | Centromere-associated protein E (CENPE)

3D structures mapped by conservation among orthologs

[ Domain: "P-loop containing nucleoside triphosphate hydrolases" // Kinesin ]

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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
CHEMBL4579162 OBDepict H 3 C O N N N O H 3 C F S N CH 3 H 3 C Cl Cl IC50 = 14.0 nM 573.52 COc1cccc2nc(C(=O)N(CCN(C)C)C3CSc4c3ccc(Cl)c4Cl)c(-c3ccc(F)c(C)c3)n12 Homo sapiens CHEMBL4427798 single protein format
CHEMBL4466617 OBDepict H 3 C O N N N O H 3 C F N CH 3 H 3 C Cl Cl IC50 = 19.0 nM 555.48 COc1cccc2nc(C(=O)N(CCN(C)C)C3CCc4c3ccc(Cl)c4Cl)c(-c3ccc(F)c(C)c3)n12 Homo sapiens CHEMBL4427798 single protein format
CHEMBL4483703 OBDepict H 3 C O N N N O H 3 C F NH N CH 3 H 3 C Cl Cl IC50 = 24.0 nM 556.47 COc1cccc2nc(C(=O)N(CCN(C)C)C3CNc4c3ccc(Cl)c4Cl)c(-c3ccc(F)c(C)c3)n12 Homo sapiens CHEMBL4427798 single protein format
CHEMBL2413142 OBDepict H 3 C N CH 3 N O N S Cl Br Cl F IC50 = 32.0 nM 569.33 CN(C)CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc2scc(Br)c2n1-c1ccc(F)cc1 Homo sapiens CHEMBL2416484 single protein format
CHEMBL2413143 OBDepict H 3 C N CH 3 N O N S Cl Cl Cl F IC50 = 35.0 nM 524.88 CN(C)CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc2scc(Cl)c2n1-c1ccc(F)cc1 Homo sapiens CHEMBL2416484 single protein format
CHEMBL2413146 OBDepict H 3 C N CH 3 N O N N Cl Br Cl F IC50 = 50.0 nM 564.29 CN(C)CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1nc2cccc(Br)n2c1-c1ccc(F)cc1 Homo sapiens CHEMBL2416484 single protein format
CHEMBL2413135 OBDepict H 3 C N CH 3 N O N O H 3 C S F Cl Cl IC50 = 72.0 nM 532.47 CN(C)CCn1c(C(=O)N(C)Cc2ccc(Cl)c(Cl)c2)c(-c2ccc(F)cc2)c2cscc2c1=O Homo sapiens CHEMBL2416484 single protein format
CHEMBL2413137 OBDepict CH 3 N CH 3 N O N CH 3 O Cl S Cl F IC50 = 100.0 nM 532.47 CN(C)CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1c(-c2ccc(F)cc2)c2cscc2c(=O)n1C Homo sapiens CHEMBL2416484 single protein format
CHEMBL2413144 OBDepict H 3 C N CH 3 N O N S Cl Cl F F F F IC50 = 140.0 nM 558.43 CN(C)CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc2scc(C(F)(F)F)c2n1-c1ccc(F)cc1 Homo sapiens CHEMBL2416484 single protein format
CHEMBL2413136 OBDepict H 3 C N CH 3 N O N O H 3 C S F Cl Cl IC50 = 300.0 nM 546.5 CN(C)CCCn1c(C(=O)N(C)Cc2ccc(Cl)c(Cl)c2)c(-c2ccc(F)cc2)c2cscc2c1=O Homo sapiens CHEMBL2416484 single protein format
CHEMBL2413141 OBDepict H 3 C N CH 3 N O N S Cl H 3 C Cl F IC50 = 370.0 nM 504.46 Cc1csc2cc(C(=O)N(CCN(C)C)Cc3ccc(Cl)c(Cl)c3)n(-c3ccc(F)cc3)c12 Homo sapiens CHEMBL2416484 single protein format
CHEMBL2413145 OBDepict N S N N O F N CH 3 H 3 C Cl Cl IC50 = 540.0 nM 515.44 CN(C)CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc2scc(C#N)c2n1-c1ccc(F)cc1 Homo sapiens CHEMBL2416484 single protein format