Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'G-protein coupled receptor 39' and Ligand = 'BDBM50232366'   

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
G-protein coupled receptor 39 (Homo sapiens (Human))	BDBM50232366 (CHEMBL4065636) Show SMILES Cc1nn(c2NC(=O)CC(c12)c1ccc(COc2cccc(Cl)c2)cc1)-c1nc(C)cc(C)n1 Show InChI InChI=1S/C26H24ClN5O2/c1-15-11-16(2)29-26(28-15)32-25-24(17(3)31-32)22(13-23(33)30-25)19-9-7-18(8-10-19)14-34-21-6-4-5-20(27)12-21/h4-12,22H,13-14H2,1-3H3,(H,30,33)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Agonist activity at human GPR39 expressed in HEK293 cells co-expressing Galphaq assessed as myo-[2-3H]inositol phosphate accumulation measured after ...				J Med Chem 60: 886-898 (2017) Article DOI: 10.1021/acs.jmedchem.6b00648 BindingDB Entry DOI: 10.7270/Q2VT1VBV
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