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 = 'BDBM50254148'   

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))	BDBM50254148 (CHEMBL4082602) Show SMILES COc1ccc2ncc(F)c([C@@H](O)CC[C@@H]3CCN(C[C@@H]3C(O)=O)C3CC(C3)c3ncccc3F)c2c1 |r,wU:11.11,15.14,20.21,(35.33,-32.01,;36.67,-31.25,;37.99,-32.01,;37.99,-33.56,;39.33,-34.33,;40.66,-33.55,;42,-34.32,;43.34,-33.54,;43.33,-31.99,;44.66,-31.22,;41.99,-31.24,;41.98,-29.69,;40.64,-28.93,;43.31,-28.91,;44.65,-29.68,;45.99,-28.9,;47.31,-29.67,;48.64,-28.9,;48.64,-27.36,;47.3,-26.59,;45.97,-27.36,;44.63,-26.6,;43.3,-27.38,;44.62,-25.06,;49.98,-26.59,;51.46,-26.99,;51.85,-25.5,;50.36,-25.11,;53.18,-24.73,;54.51,-25.5,;55.85,-24.73,;55.85,-23.19,;54.5,-22.42,;53.17,-23.2,;51.83,-22.43,;40.66,-32,;39.33,-31.24,)| Show InChI InChI=1S/C28H31F2N3O4/c1-37-19-5-6-24-20(13-19)26(23(30)14-32-24)25(34)7-4-16-8-10-33(15-21(16)28(35)36)18-11-17(12-18)27-22(29)3-2-9-31-27/h2-3,5-6,9,13-14,16-18,21,25,34H,4,7-8,10-12,15H2,1H3,(H,35,36)/t16-,17?,18?,21+,25+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.07E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Worldwide Research and Development, Groton, CT 06340, USA. Electronic address: mitton-fry.1@osu.edu. Curated by ChEMBL					Assay Description Inhibition of human ERG				Bioorg Med Chem Lett 27: 3353-3358 (2017) Article DOI: 10.1016/j.bmcl.2017.06.009 BindingDB Entry DOI: 10.7270/Q21R6SZV
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