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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Baculoviral IAP repeat-containing protein 2 [256-363]' and Ligand = 'BDBM213401'   
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
Baculoviral IAP repeat-containing protein 2 [256-363]


(Homo sapiens (Human))
BDBM213401
PNG
(US9278978, 36)
Show SMILES CNC(C)C(=O)Nc1cc(-c2cccnc2)c(-c2cncnc2)c(n1)C#Cc1ccccc1
Show InChI InChI=1S/C26H22N6O/c1-18(27-2)26(33)32-24-13-22(20-9-6-12-28-14-20)25(21-15-29-17-30-16-21)23(31-24)11-10-19-7-4-3-5-8-19/h3-9,12-18,27H,1-2H3,(H,31,32,33)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 172n/an/an/an/an/a25



Boehringer Ingelheim International GmbH

US Patent


Assay Description
BIR3 domains (10 nM) were incubated with SMAC peptide (10 nM) in assay buffer (50 mM Tris, 120 mM NaCl, 0.1% BSA, 1 mM DTT, 0.05% TritonX100) for one...


US Patent US9278978 (2016)


BindingDB Entry DOI: 10.7270/Q2JM28G4
More data for this
Ligand-Target Pair