BDBM50203972 CHEMBL233006::N-(4-(2-(2-chloro-4-(cyclohexylmethoxy)phenoxy)thiazol-5-yl)but-3-yn-2-yl)acetamide

SMILES: CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OCC3CCCCC3)cc2Cl)s1

InChI Key: InChIKey=AGCXZCRKZJDUMK-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 = 50203972   

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
Acetyl-CoA carboxylase 1 (ACC1) (Homo sapiens (Human))	BDBM50203972 (CHEMBL233006 | N-(4-(2-(2-chloro-4-(cyclohexylmeth...) Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OCC3CCCCC3)cc2Cl)s1 |w:1.0| Show InChI InChI=1S/C22H25ClN2O3S/c1-15(25-16(2)26)8-10-19-13-24-22(29-19)28-21-11-9-18(12-20(21)23)27-14-17-6-4-3-5-7-17/h9,11-13,15,17H,3-7,14H2,1-2H3,(H,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human recombinant ACC1				Bioorg Med Chem Lett 17: 1961-5 (2007) Article DOI: 10.1016/j.bmcl.2007.01.022 BindingDB Entry DOI: 10.7270/Q2W095KS
					More data for this Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2) (Homo sapiens (Human))	BDBM50203972 (CHEMBL233006 | N-(4-(2-(2-chloro-4-(cyclohexylmeth...) Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OCC3CCCCC3)cc2Cl)s1 |w:1.0| Show InChI InChI=1S/C22H25ClN2O3S/c1-15(25-16(2)26)8-10-19-13-24-22(29-19)28-21-11-9-18(12-20(21)23)27-14-17-6-4-3-5-7-17/h9,11-13,15,17H,3-7,14H2,1-2H3,(H,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human recombinant ACC2				Bioorg Med Chem Lett 17: 1961-5 (2007) Article DOI: 10.1016/j.bmcl.2007.01.022 BindingDB Entry DOI: 10.7270/Q2W095KS
					More data for this Ligand-Target Pair