Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'ATP-sensitive inward rectifier potassium channel 1' and Ligand = 'BDBM50121359'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
ATP-sensitive inward rectifier potassium channel 1 (Homo sapiens (Human))	BDBM50121359 (CHEMBL3622110) Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ccc(cc2)C#N)CC1 |r| Show InChI InChI=1S/C26H29N3O3/c1-18-21(6-7-22-23(18)16-32-25(22)31)24(30)15-28-11-8-26(9-12-28)10-13-29(17-26)20-4-2-19(14-27)3-5-20/h2-7,24,30H,8-13,15-17H2,1H3/t24-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Temple University School of Pharmacy Curated by ChEMBL					Assay Description Inhibition of human Kir1.1 expressed in HEK293 cells by thallium flux assay				ACS Med Chem Lett 6: 831-3 (2015) Article DOI: 10.1021/acsmedchemlett.5b00227 BindingDB Entry DOI: 10.7270/Q2377BHG
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