Reaction Details Report a problem with these data
Target
Tumor necrosis factor
Ligand
BDBM54284
Substrate
n/a
Meas. Tech.
HTS dose response assay for identification of inhibitors of TNFa-specific NF-kB induction
IC50
1404.25±281 nM
Citation
 PubChem, PC HTS dose response assay for identification of inhibitors of TNFa-specific NF-kB induction PubChem Bioassay (2010)[AID] 
Target
Name:
Tumor necrosis factor
Synonyms:
Cachectin | TNF | TNF-a | TNF-alpha | TNFA | TNFA_HUMAN | TNFSF2 | Tumor necrosis factor (TNF-alpha) | Tumor necrosis factor (TNFa) | Tumor necrosis factor alpha (TNFα) | Tumor necrosis factor ligand superfamily member 2 | Tumor necrosis factor, membrane form | Tumor necrosis factor, soluble form | tumor necrosis factor alpha
Type:
Enzyme
Mol. Mass.:
25645.11
Organism:
Homo sapiens (Human)
Description:
P01375
Residue:
233
Sequence:
MSTESMIRDVELAEEALPKKTGGPQGSRRCLFLSLFSFLIVAGATTLFCLLHFGVIGPQREEFPRDLSLISPLAQAVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQLVVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIKSPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESGQVYFGIIAL
  
Inhibitor
Name:
BDBM54284
Synonyms:
(6-amino-5-nitro-pyrimidin-4-yl)-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methyleneamino]amine | 4-N-[(2,5-dimethyl-1-phenylpyrrol-3-yl)methylideneamino]-5-nitropyrimidine-4,6-diamine | MLS000392314 | N4-[(2,5-dimethyl-1-phenyl-3-pyrrolyl)methylideneamino]-5-nitropyrimidine-4,6-diamine | N4-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylideneamino]-5-nitro-pyrimidine-4,6-diamine | SMR000261229 | cid_4647710
Type:
Small organic molecule
Emp. Form.:
C17H17N7O2
Mol. Mass.:
351.3626
SMILES:
Cc1cc(CN=Nc2ncnc(N)c2[N+]([O-])=O)c(C)n1-c1ccccc1 |w:5.4|
Structure:
Search PDB for entries with ligand similarity: