Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cytochrome P450 2A5' and Ligand = 'BDBM50159242'   

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
Cytochrome P450 2A5 (Mus musculus)	BDBM50159242 (1-(7-Methyl-naphthalen-2-yl)-ethanone | 1-(7-methy...) Show SMILES CC(=O)c1ccc2ccc(C)cc2c1 Show InChI InChI=1S/C13H12O/c1-9-3-4-11-5-6-12(10(2)14)8-13(11)7-9/h3-8H,1-2H3	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibitory concentration against mouse cytochrome P450 2A5				J Med Chem 48: 440-9 (2005) Article DOI: 10.1021/jm049536b BindingDB Entry DOI: 10.7270/Q20C4WJV
					More data for this Ligand-Target Pair
Cytochrome P450 2A5 (Mus musculus)	BDBM50159242 (1-(7-Methyl-naphthalen-2-yl)-ethanone | 1-(7-methy...) Show SMILES CC(=O)c1ccc2ccc(C)cc2c1 Show InChI InChI=1S/C13H12O/c1-9-3-4-11-5-6-12(10(2)14)8-13(11)7-9/h3-8H,1-2H3	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Jadavpur University Curated by ChEMBL					Assay Description Inhibition of mouse CYP2A5				Eur J Med Chem 44: 1941-51 (2009) Article DOI: 10.1016/j.ejmech.2008.11.010 BindingDB Entry DOI: 10.7270/Q2PZ5B1Z
					More data for this Ligand-Target Pair