Reaction Details Report a problem with these data
Target
Acetyl-CoA carboxylase
Ligand
BDBM429403
Substrate
n/a
Meas. Tech.
ACCase Enzymatic Assay
IC50
113±n/a nM
Citation
Slomczynska, U; Dimmic, MW; Haakenson, Jr., WP; Bennett, JL; Shortt, BJ; Taylor, CM; Williams, DJ; Slater, M Acetyl-CoA carboxylase modulators US Patent US10548313 Publication Date 2/4/2020
More Info.:
Target
Name:
Acetyl-CoA carboxylase
Synonyms:
6.4.1.2 | ACCase | Acetyl-CoA carboxylase
Type:
PROTEIN
Mol. Mass.:
12114.64
Organism:
Zea mays
Description:
ChEMBL_106638
Residue:
109
Sequence:
DSATKTAQALLDFNREGLPLFILANWRGFSGGQRDLFEGILQAGSTIVENLRTYNQPAFVYIPMAGELRGGAWVVVDSKINPDRIECYAERTAKGNVLEPQGLIEIKFR
Inhibitor
Name:
BDBM429403
Synonyms:
2-((3-cyano-4-(4- methoxyphenyl)-6-(thiophen- 2-yl)pyridin-2- yl)thio)butanoic acid | US10548313, Formula Ia-xxix | US11375716, Formula Ia-xxix
Type:
Small organic molecule
Emp. Form.:
C21H18N2O3S2
Mol. Mass.:
410.509
SMILES:
CCC(Sc1nc(cc(-c2ccc(OC)cc2)c1C#N)-c1cccs1)C(O)=O