P35790 | CHKA_HUMAN | Choline kinase alpha (CHKA)
3D structures mapped by conservation among orthologs
[ Domain: "Protein kinase" // Fructosamin_kin ]
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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 |
|---|---|---|---|---|---|---|---|---|---|---|
| CHEMBL3765554 | IC50 | = | 20.0 | nM | 421.58 | O[C@](CCc1ccccc1OC1CCOCC1)(c1ccccc1)C1CN2CCC1CC2 | Homo sapiens | CHEMBL3766475 | single protein format | |
| CHEMBL3763540 | IC50 | = | 66.0 | nM | 431.63 | CN1CCCN(Cc2ccc(-c3ccc(CN4CCCN(C)CC4)cc3C#N)cc2)CC1 | Homo sapiens | CHEMBL3769133 | single protein format | |
| CHEMBL3763931 | IC50 | = | 85.0 | nM | 449.62 | CN1CCCN(Cc2ccc(-c3ccc(CN4CCCN(C)CC4)cc3C#N)c(F)c2)CC1 | Homo sapiens | CHEMBL3769133 | single protein format | |
| CHEMBL3763982 | IC50 | = | 165.0 | nM | 424.61 | CN1CCCN(Cc2ccc(-c3ccc(CN4CCCN(C)CC4)cc3F)cc2)CC1 | Homo sapiens | CHEMBL3769133 | single protein format | |
| CHEMBL3764278 | IC50 | = | 233.0 | nM | 442.6 | CN1CCCN(Cc2ccc(-c3ccc(CN4CCCN(C)CC4)c(F)c3F)cc2)CC1 | Homo sapiens | CHEMBL3769133 | single protein format | |
| CHEMBL3765239 | IC50 | = | 251.0 | nM | 420.6 | CN1CCCN(Cc2ccc(-c3ccc(C(=O)N4CCCN(C)CC4)cc3)cc2)CC1 | Homo sapiens | CHEMBL3769133 | single protein format | |
| CHEMBL3763453 | IC50 | = | 255.0 | nM | 442.6 | CN1CCCN(Cc2ccc(-c3cc(F)c(CN4CCCN(C)CC4)c(F)c3)cc2)CC1 | Homo sapiens | CHEMBL3769133 | single protein format | |
| CHEMBL3763792 | IC50 | = | 268.0 | nM | 441.06 | CN1CCCN(Cc2ccc(-c3ccc(CN4CCCN(C)CC4)c(Cl)c3)cc2)CC1 | Homo sapiens | CHEMBL3769133 | single protein format | |
| CHEMBL125148 | IC50 | = | 300.0 | nM | 554.33 | [Br-].[Br-].c1cc2cc(c1)CNc1cc[n+](cc1)Cc1ccc(cc1)C[n+]1ccc(cc1)NC2 | Homo sapiens | CHEMBL662980 | single protein format | |
| CHEMBL3763801 | IC50 | = | 457.0 | nM | 406.62 | CN1CCCN(Cc2ccc(-c3ccc(CN4CCCN(C)CC4)cc3)cc2)CC1 | Homo sapiens | CHEMBL3769133 | single protein format |