Reaction Details Report a problem with these data
Target
Tumor necrosis factor
Ligand
BDBM102720
Substrate
n/a
Meas. Tech.
Inhibition Assay
Ki
0.18±0.0 nM
IC50
69±0.0 nM
Citation
 Kozlowski, JA; Yu, W; Wong, MK; Kim, SH; Tong, L; Lavey, BJ; Shankar, BB; Yang, D; Feltz, R; Kosinski, AM; Zhou, G; Rizvi, RK; Dai, C; Fire, L; Girijavallabhan, V; Li, D; Popovici-Muller, J; Richard, JE; Rosner, KE; Siddiqui, MA; Yang, L Compounds for the treatment of inflammatory disorders US Patent  US8541572 Publication Date 9/24/2013 
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 (TNF) | 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:
Human
Description:
P01375
Residue:
233
Sequence:
MSTESMIRDVELAEEALPKKTGGPQGSRRCLFLSLFSFLIVAGATTLFCLLHFGVIGPQREEFPRDLSLISPLAQAVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQLVVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIKSPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESGQVYFGIIAL
  
Inhibitor
Name:
BDBM102720
Synonyms:
US8541572, 1311
Type:
Small organic molecule
Emp. Form.:
C29H30F2N6O5
Mol. Mass.:
580.5825
SMILES:
CCN1CCN(C(N=O)c2ccc(cc2F)C#C[C@]2(CN3Cc4ccc(OC)c(F)c4C3=O)NC(=O)NC2=O)[C@@H](C)C1 |r|
Structure:
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