BDBM50259134 CHEMBL466720::N-(3-(3,4-dichlorobenzyl)-4-oxo-3,4-dihydroquinazolin-6-yl)-2-phenoxyacetamide

SMILES: Clc1ccc(Cn2cnc3ccc(NC(=O)COc4ccccc4)cc3c2=O)cc1Cl

InChI Key: InChIKey=KOAUQKJNSJNVIB-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50259134   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Stearoyl-CoA desaturase 1 (SCD1) (Rattus norvegicus (Rat))	BDBM50259134 (CHEMBL466720 | N-(3-(3,4-dichlorobenzyl)-4-oxo-3,4...) Show SMILES Clc1ccc(Cn2cnc3ccc(NC(=O)COc4ccccc4)cc3c2=O)cc1Cl Show InChI InChI=1S/C23H17Cl2N3O3/c24-19-8-6-15(10-20(19)25)12-28-14-26-21-9-7-16(11-18(21)23(28)30)27-22(29)13-31-17-4-2-1-3-5-17/h1-11,14H,12-13H2,(H,27,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	268	n/a	n/a	n/a	n/a	n/a	n/a
CV Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibition of rat microsomal delta(9)-desaturase				Bioorg Med Chem Lett 19: 3050-3 (2009) Article DOI: 10.1016/j.bmcl.2009.04.004 BindingDB Entry DOI: 10.7270/Q2W095TX
					More data for this Ligand-Target Pair
Stearoyl-CoA desaturase 1 (Homo sapiens (Human))	BDBM50259134 (CHEMBL466720 | N-(3-(3,4-dichlorobenzyl)-4-oxo-3,4...) Show SMILES Clc1ccc(Cn2cnc3ccc(NC(=O)COc4ccccc4)cc3c2=O)cc1Cl Show InChI InChI=1S/C23H17Cl2N3O3/c24-19-8-6-15(10-20(19)25)12-28-14-26-21-9-7-16(11-18(21)23(28)30)27-22(29)13-31-17-4-2-1-3-5-17/h1-11,14H,12-13H2,(H,27,29)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
CV Therapeutics, Inc Curated by ChEMBL					Assay Description Inhibition of delta(9)-desaturase from human HepG2 cells				Bioorg Med Chem Lett 19: 3050-3 (2009) Article DOI: 10.1016/j.bmcl.2009.04.004 BindingDB Entry DOI: 10.7270/Q2W095TX
					More data for this Ligand-Target Pair