Reaction Details Report a problem with these data
Target
Acetyl-CoA carboxylase
Ligand
BDBM429413
Substrate
n/a
Meas. Tech.
ACCase Enzymatic Assay
IC50
4093±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:
BDBM429413
Synonyms:
2-((2-hydroxy-1- phenylethyl)thio)-4- (thiophen-2-yl)-5,6,7,8- tetrahydroquinoline-3- carbonitrile | US10548313, Formula IIb-ii | US11375716, Formula IIb-ii
Type:
Small organic molecule
Emp. Form.:
C22H20N2OS2
Mol. Mass.:
392.537
SMILES:
OCC(Sc1nc2CCCCc2c(-c2cccs2)c1C#N)c1ccccc1