Reaction Details Report a problem with these data
Target
Glutathione S-transferase omega-1
Ligand
BDBM50526133
Substrate
n/a
Meas. Tech.
ChEMBL_1899134 (CHEMBL4401249)
IC50
25±n/a nM
Citation
 Dai, W; Samanta, S; Xue, D; Petrunak, EM; Stuckey, JA; Han, Y; Sun, D; Wu, Y; Neamati, N Structure-Based Design of N-(5-Phenylthiazol-2-yl)acrylamides as Novel and Potent Glutathione S-Transferase Omega 1 Inhibitors. J Med Chem 62:3068-3087 (2019) [PubMed]  Article 
Target
Name:
Glutathione S-transferase omega-1
Synonyms:
GSTO 1-1 | GSTO1 | GSTO1_HUMAN | GSTTLP28 | Glutathione S-transferase omega-1 | Glutathione transferase omega 1 | glutathione S-transferase omega-1 isoform 1
Type:
PROTEIN
Mol. Mass.:
27565.54
Organism:
Homo sapiens (Human)
Description:
EBI_11172
Residue:
241
Sequence:
MSGESARSLGKGSAPPGPVPEGSIRIYSMRFCPFAERTRLVLKAKGIRHEVININLKNKPEWFFKKNPFGLVPVLENSQGQLIYESAITCEYLDEAYPGKKLLPDDPYEKACQKMILELFSKVPSLVGSFIRSQNKEDYAGLKEEFRKEFTKLEEVLTNKKTTFFGGNSISMIDYLIWPWFERLEAMKLNECVDHTPKLKLWMAAMKEDPTVSALLTSEKDWQGFLELYLQNSPEACDYGL
  
Inhibitor
Name:
BDBM50526133
Synonyms:
CHEMBL4443686
Type:
Small organic molecule
Emp. Form.:
C18H14F3N3O2S
Mol. Mass.:
393.383
SMILES:
Cc1cc(CN(C(=O)C=C)c2nc(cs2)-c2ccc(cc2)C(F)(F)F)on1
Structure:
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