Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Fatty acid-binding protein, adipocyte' and Ligand = 'BDBM212449'   

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
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM212449 (US9278918, 35) Show SMILES OC(=O)C1(CCC1)NC(=O)Nc1cc(Cl)ccc1-c1ccccc1 Show InChI InChI=1S/C18H17ClN2O3/c19-13-7-8-14(12-5-2-1-3-6-12)15(11-13)20-17(24)21-18(16(22)23)9-4-10-18/h1-3,5-8,11H,4,9-10H2,(H,22,23)(H2,20,21,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	810	n/a	n/a	n/a	n/a	7.5	25
Hoffmann-La Roche Inc. US Patent					Assay Description Stock DMSO solutions (1.8 mM) of compounds were serially diluted 3-fold for ten concentrations with 100% DMSO (50 uM to 0.003 uM final compound conce...				US Patent US9278918 (2016) BindingDB Entry DOI: 10.7270/Q28914P6
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