Reaction Details Report a problem with these data
Target
Signal transducer and activator of transcription 3 [702-738,740-752]
Ligand
BDBM46381
Substrate
n/a
Meas. Tech.
Dose response cell-based assay to measure STAT3 inhibition
IC50
9221±n/a nM
Citation
 PubChem, PC Dose response cell-based assay to measure STAT3 inhibition PubChem Bioassay (2008)[AID] 
Target
Name:
Signal transducer and activator of transcription 3 [702-738,740-752]
Synonyms:
APRF | STAT3 | STAT3_HUMAN
Type:
Enzyme Catalytic Domain
Mol. Mass.:
5263.93
Organism:
Homo sapiens (Human)
Description:
gi_13272532
Residue:
50
Sequence:
AAPYLKTKFICVTPTTCSNTIDLPMSPRTLDSLMQFGNGEGAEPSAGGQF
  
Inhibitor
Name:
BDBM46381
Synonyms:
2-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl benzoate | MLS000545576 | SMR000164189 | [2-(5-methyl-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)phenyl] benzoate | [2-[5-methyl-1,3-bis(oxidanylidene)-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]phenyl] benzoate | benzoic acid [2-(1,3-diketo-5-methyl-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)phenyl] ester | benzoic acid [2-(5-methyl-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)phenyl] ester | cid_4983290
Type:
Small organic molecule
Emp. Form.:
C22H21NO4
Mol. Mass.:
363.4064
SMILES:
CC1CCc2c(O)n(c(O)c2C1)-c1ccccc1OC(=O)c1ccccc1 |(3.08,4.19,;4.41,3.42,;4.41,1.88,;5.75,1.11,;7.08,1.88,;8.54,1.41,;9.02,-.05,;9.44,2.65,;8.54,3.89,;9.02,5.35,;7.08,3.42,;5.75,4.19,;10.98,2.65,;11.75,3.98,;13.29,3.98,;14.06,2.65,;13.29,1.32,;11.75,1.32,;10.98,-.02,;11.75,-1.35,;13.29,-1.35,;10.98,-2.69,;9.44,-2.69,;8.67,-4.02,;9.44,-5.35,;10.98,-5.35,;11.75,-4.02,)|
Structure:
Search PDB for entries with ligand similarity: