BDBM50195045 CHEMBL221168::N-(4-(2-(2-ethoxyphenoxy)thiazol-5-yl)but-3-yn-2-yl)acetamide

SMILES: CCOc1ccccc1Oc1ncc(s1)C#CC(C)NC(C)=O

InChI Key: InChIKey=PYQCVMJFBMJPEN-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 = 50195045   

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))	BDBM50195045 (CHEMBL221168 | N-(4-(2-(2-ethoxyphenoxy)thiazol-5-...) Show SMILES CCOc1ccccc1Oc1ncc(s1)C#CC(C)NC(C)=O Show InChI InChI=1S/C17H18N2O3S/c1-4-21-15-7-5-6-8-16(15)22-17-18-11-14(23-17)10-9-12(2)19-13(3)20/h5-8,11-12H,4H2,1-3H3,(H,19,20)	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 16: 6078-81 (2006) Article DOI: 10.1016/j.bmcl.2006.08.100 BindingDB Entry DOI: 10.7270/Q2RJ4J4W
					More data for this Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2) (Homo sapiens (Human))	BDBM50195045 (CHEMBL221168 | N-(4-(2-(2-ethoxyphenoxy)thiazol-5-...) Show SMILES CCOc1ccccc1Oc1ncc(s1)C#CC(C)NC(C)=O Show InChI InChI=1S/C17H18N2O3S/c1-4-21-15-7-5-6-8-16(15)22-17-18-11-14(23-17)10-9-12(2)19-13(3)20/h5-8,11-12H,4H2,1-3H3,(H,19,20)	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	1.31E+3	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 16: 6078-81 (2006) Article DOI: 10.1016/j.bmcl.2006.08.100 BindingDB Entry DOI: 10.7270/Q2RJ4J4W
					More data for this Ligand-Target Pair