BDBM50350738 CHEMBL1818193

SMILES: Cc1noc(C)c1-c1cc(C(=O)NC[C@H]2CC[C@H](CNC(=O)OC(C)(C)C)CC2)c2ccccc2n1

InChI Key: InChIKey=KNYZHVCDQURJGN-MXVIHJGJSA-N

Data: 1 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 1 hit for monomerid = 50350738   

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 2 (ACC2) (Homo sapiens (Human))	BDBM50350738 (CHEMBL1818193) Show SMILES Cc1noc(C)c1-c1cc(C(=O)NC[C@H]2CC[C@H](CNC(=O)OC(C)(C)C)CC2)c2ccccc2n1 |r,wU:17.18,wD:14.14,(18.21,-43.88,;19.36,-42.85,;20.86,-43.17,;21.63,-41.83,;20.6,-40.69,;20.92,-39.18,;19.19,-41.32,;17.86,-40.56,;17.85,-39.02,;16.52,-38.26,;16.52,-36.72,;17.86,-35.95,;15.19,-35.95,;15.19,-34.41,;13.86,-33.64,;13.86,-32.1,;12.53,-31.32,;11.2,-32.1,;9.87,-31.33,;9.86,-29.79,;8.53,-29.02,;8.52,-27.48,;7.19,-29.8,;5.86,-29.03,;4.53,-29.81,;5.85,-27.49,;4.52,-28.26,;11.2,-33.64,;12.53,-34.4,;15.19,-39.03,;13.87,-38.26,;12.54,-39.02,;12.54,-40.56,;13.86,-41.32,;15.18,-40.56,;16.52,-41.33,)| Show InChI InChI=1S/C28H36N4O4/c1-17-25(18(2)36-32-17)24-14-22(21-8-6-7-9-23(21)31-24)26(33)29-15-19-10-12-20(13-11-19)16-30-27(34)35-28(3,4)5/h6-9,14,19-20H,10-13,15-16H2,1-5H3,(H,29,33)(H,30,34)/t19-,20-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Research and Development Curated by ChEMBL					Assay Description Inhibition of human recombinant his-tagged ACC2 expressed in baculovirus/Sf9 cell assessed as inorganic phosphate formation preincubated for 15 mins ...				Bioorg Med Chem 19: 3039-53 (2011) Article DOI: 10.1016/j.bmc.2011.04.014 BindingDB Entry DOI: 10.7270/Q2G44QN2
					More data for this Ligand-Target Pair