new BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tumor necrosis factor receptor R1' and Ligand = 'BDBM50255013'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Tumor necrosis factor receptor R1


(Homo sapiens (Human))
BDBM50255013
PNG
((S)-5-((2,4-diamino-4-oxobutanamido)methyl)-3,4-di...)
Show SMILES N[C@@H](CC(N)=O)C(=O)NCc1cc(C(O)=O)c(Nc2ccc(I)cc2F)c(F)c1F |r|
Show InChI InChI=1S/C18H16F3IN4O4/c19-10-4-8(22)1-2-12(10)26-16-9(18(29)30)3-7(14(20)15(16)21)6-25-17(28)11(23)5-13(24)27/h1-4,11,26H,5-6,23H2,(H2,24,27)(H,25,28)(H,29,30)/t11-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.30E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Binding affinity to TRAK-A (unknown origin)


Bioorg Med Chem Lett 19: 226-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.108
BindingDB Entry DOI: 10.7270/Q22F7N98
More data for this
Ligand-Target Pair