BDBM50203977 CHEMBL397164::N-(4-(2-(2-amino-4-isobutoxyphenoxy)thiazol-5-yl)but-3-yn-2-yl)acetamide

SMILES: CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(N)c1

InChI Key: InChIKey=VFCWKZFPARAKJK-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 = 50203977   

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))	BDBM50203977 (CHEMBL397164 | N-(4-(2-(2-amino-4-isobutoxyphenoxy...) Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(N)c1 |w:17.18| Show InChI InChI=1S/C19H23N3O3S/c1-12(2)11-24-15-6-8-18(17(20)9-15)25-19-21-10-16(26-19)7-5-13(3)22-14(4)23/h6,8-10,12-13H,11,20H2,1-4H3,(H,22,23)	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))	BDBM50203977 (CHEMBL397164 | N-(4-(2-(2-amino-4-isobutoxyphenoxy...) Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(N)c1 |w:17.18| Show InChI InChI=1S/C19H23N3O3S/c1-12(2)11-24-15-6-8-18(17(20)9-15)25-19-21-10-16(26-19)7-5-13(3)22-14(4)23/h6,8-10,12-13H,11,20H2,1-4H3,(H,22,23)	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	1.58E+4	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