Reaction Details Report a problem with these data
Target
Acetyl-CoA carboxylase
Ligand
BDBM429414
Substrate
n/a
Meas. Tech.
ACCase Enzymatic Assay
IC50
2184±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 
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:
BDBM429414
Synonyms:
4-(furan-2-yl)-2-((2-hydroxy- 1-phenylethyl)thio)-6- (thiophen-2-yl)nicotinonitrile | US10548313, Formula IIb-iv | US11375716, Formula IIb-iv
Type:
Small organic molecule
Emp. Form.:
C22H16N2O2S2
Mol. Mass.:
404.505
SMILES:
OCC(Sc1nc(cc(-c2ccco2)c1C#N)-c1cccs1)c1ccccc1
Structure:
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