Reaction Details Report a problem with these data
Target
Mothers against decapentaplegic homolog 3
Ligand
BDBM41960
Substrate
n/a
Meas. Tech.
SMAD Transcription Factor Inhibitors Secondary Dose Response Confirmation
IC50
>50000±n/a nM
Citation
 PubChem, PC SMAD Transcription Factor Inhibitors Secondary Dose Response Confirmation PubChem Bioassay (2008)[AID] 
Target
Name:
Mothers against decapentaplegic homolog 3
Synonyms:
MADH3 | SMAD3 | SMAD3_HUMAN
Type:
Enzyme Catalytic Domain
Mol. Mass.:
48085.78
Organism:
Homo sapiens (Human)
Description:
gi_5174513
Residue:
425
Sequence:
MSSILPFTPPIVKRLLGWKKGEQNGQEEKWCEKAVKSLVKKLKKTGQLDELEKAITTQNVNTKCITIPRSLDGRLQVSHRKGLPHVIYCRLWRWPDLHSHHELRAMELCEFAFNMKKDEVCVNPYHYQRVETPVLPPVLVPRHTEIPAEFPPLDDYSHSIPENTNFPAGIEPQSNIPETPPPGYLSEDGETSDHQMNHSMDAGSPNLSPNPMSPAHNNLDLQPVTYCEPAFWCSISYYELNQRVGETFHASQPSMTVDGFTDPSNSERFCLGLLSNVNRNAAVELTRRHIGRGVRLYYIGGEVFAECLSDSAIFVQSPNCNQRYGWHPATVCKIPPGCNLKIFNNQEFAALLAQSVNQGFEAVYQLTRMCTIRMSFVKGWGAEYRRQTVTSTPCWIELHLNGPLQWLDKVLTQMGSPSIRCSSVS
  
Inhibitor
Name:
BDBM41960
Synonyms:
2-(3,4,5-trihydroxy-6-keto-8a,9-dihydroxanthen-9-yl)benzoic acid methyl ester | 2-(3,4,5-trihydroxy-6-oxo-8a,9-dihydroxanthen-9-yl)benzoic acid methyl ester | TG2-194 | cid_24178297 | methyl 2-(3,4,5-trihydroxy-6-oxo-8a,9-dihydroxanthen-9-yl)benzoate | methyl 2-[3,4,5-tris(oxidanyl)-6-oxidanylidene-8a,9-dihydroxanthen-9-yl]benzoate
Type:
Small organic molecule
Emp. Form.:
C21H16O7
Mol. Mass.:
380.3475
SMILES:
COC(=O)c1ccccc1C1C2C=CC(=O)C(=O)C2Oc2c(O)c(O)ccc12 |c:13|
Structure:
Search PDB for entries with ligand similarity: