Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetAspartate aminotransferase, cytoplasmic
LigandBDBM50462464
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1775622 (CHEMBL4232614)
IC50 36000±n/a nM
Citation Anglin, JZavareh, RBSander, PNHaldar, DMullarky, ECantley, LCKimmelman, ACLyssiotis, CALairson, LL Discovery and optimization of aspartate aminotransferase 1 inhibitors to target redox balance in pancreatic ductal adenocarcinoma. Bioorg Med Chem Lett28:2675-2678 (2018) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Aspartate aminotransferase, cytoplasmic
Name:Aspartate aminotransferase, cytoplasmic
Synonyms:2.6.1.1 | 2.6.1.3 | AATC_HUMAN | Aspartate aminotransferase, cytoplasmic | Cysteine aminotransferase, cytoplasmic | Cysteine transaminase, cytoplasmic | GOT1 | Glutamate oxaloacetate transaminase 1 | Transaminase A | cAspAT | cCAT
Type:PROTEIN
Mol. Mass.:46249.45
Organism:Homo sapiens
Description:ChEMBL_105469
Residue:413
Sequence:
MAPPSVFAEVPQAQPVLVFKLTADFREDPDPRKVNLGVGAYRTDDCHPWVLPVVKKVEQK
IANDNSLNHEYLPILGLAEFRSCASRLALGDDSPALKEKRVGGVQSLGGTGALRIGADFL
ARWYNGTNNKNTPVYVSSPTWENHNAVFSAAGFKDIRSYRYWDAEKRGLDLQGFLNDLEN
APEFSIVVLHACAHNPTGIDPTPEQWKQIASVMKHRFLFPFFDSAYQGFASGNLERDAWA
IRYFVSEGFEFFCAQSFSKNFGLYNERVGNLTVVGKEPESILQVLSQMEKIVRITWSNPP
AQGARIVASTLSNPELFEEWTGNVKTMADRILTMRSELRARLEALKTPGTWNHITDQIGM
FSFTGLNPKQVEYLVNEKHIYLLPSGRINVSGLTTKNLDYVATSIHEAVTKIQ
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50462464
n/a
NameBDBM50462464
Synonyms:CHEMBL4239817
TypeSmall organic molecule
Emp. Form.C17H16ClN3O
Mol. Mass.313.781
SMILESClc1ccc(NC(=O)NCCc2c[nH]c3ccccc23)cc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: