Reaction Details Report a problem with these data
Target
Glutathione S-transferase P
Ligand
BDBM50038325
Substrate
n/a
Meas. Tech.
ChEMBL_2081222 (CHEMBL4737013)
Ki
1850±n/a nM
Citation
 Liu, Q; Liu, Z; Hua, W; Gou, S Discovery of 6-(7-Nitro-2,1,3-benzoxadiazol-4-ylthio)hexanol Derivatives as Glutathione Transferase Inhibitors with Favorable Selectivity and Tolerated Toxicity. J Med Chem 64:1701-1712 (2021) [PubMed]  Article 
Target
Name:
Glutathione S-transferase P
Synonyms:
FAEES3 | GST class-pi | GST3 | GSTP1 | GSTP1-1 | GSTP1_HUMAN | Glutathione S-transferase | Glutathione S-transferase (GST) | Glutathione S-transferase P | Glutathione S-transferase Pi | Glutathione transferase (GST)
Type:
Enzyme
Mol. Mass.:
23353.53
Organism:
Homo sapiens (Human)
Description:
P09211
Residue:
210
Sequence:
MPPYTVVYFPVRGRCAALRMLLADQGQSWKEEVVTVETWQEGSLKASCLYGQLPKFQDGDLTLYQSNTILRHLGRTLGLYGKDQQEAALVDMVNDGVEDLRCKYISLIYTNYEAGKDDYVKALPGQLKPFETLLSQNQGGKTFIVGDQISFADYNLLDLLLIHEVLAPGCLDAFPLLSAYVGRLSARPKLKAFLASPEYVNLPINGNGKQ
  
Inhibitor
Name:
BDBM50038325
Synonyms:
CHEMBL1234570
Type:
Small organic molecule
Emp. Form.:
C12H15N3O4S
Mol. Mass.:
297.33
SMILES:
OCCCCCCSc1ccc([N+]([O-])=O)c2nonc12
Structure:
Search PDB for entries with ligand similarity: