Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Potassium voltage-gated channel subfamily H member 2' and Ligand = 'BDBM50523606'   

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
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50523606 (CHEMBL4461166) Show SMILES OC(=O)C[C@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2c(F)cccc2[nH]1 |r,wU:7.10,wD:4.3,(75.44,-57.01,;74.68,-55.67,;73.14,-55.65,;75.46,-54.34,;74.71,-53,;75.49,-51.67,;74.72,-50.32,;73.19,-50.33,;72.41,-51.65,;73.16,-52.98,;72.43,-48.99,;70.89,-48.99,;70.11,-50.31,;68.58,-50.31,;67.82,-48.97,;68.58,-47.64,;70.12,-47.65,;66.29,-48.97,;65.51,-47.63,;63.97,-47.64,;63.21,-48.97,;63.97,-50.3,;65.51,-50.3,;61.67,-48.97,;60.77,-47.72,;59.29,-48.19,;57.96,-47.43,;57.95,-45.89,;56.63,-48.2,;56.63,-49.74,;57.96,-50.52,;59.29,-49.74,;60.76,-50.22,)| Show InChI InChI=1S/C25H29FN4O3/c26-20-2-1-3-21-24(20)29-25(28-21)17-6-9-22(27-15-17)30-12-10-19(11-13-30)33-18-7-4-16(5-8-18)14-23(31)32/h1-3,6,9,15-16,18-19H,4-5,7-8,10-14H2,(H,28,29)(H,31,32)/t16-,18-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.07E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck & Co. Inc Curated by ChEMBL					Assay Description Inhibition of human ERG				Bioorg Med Chem Lett 29: 1380-1385 (2019) Article DOI: 10.1016/j.bmcl.2019.03.039 BindingDB Entry DOI: 10.7270/Q2348PSJ
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