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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'BRD4 BD1 (aa 42-168)' and Ligand = 'BDBM310890'   
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
BRD4 BD1 (aa 42-168)


(Homo sapiens (Human))
BDBM310890
PNG
(N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridi...)
Show SMILES CN(C(=O)c1ccc(cc1)-c1cn(C)c(=O)c2[nH]ccc12)c1ccccc1
Show InChI InChI=1S/C22H19N3O2/c1-24-14-19(18-12-13-23-20(18)22(24)27)15-8-10-16(11-9-15)21(26)25(2)17-6-4-3-5-7-17/h3-14,23H,1-2H3
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 340n/an/an/an/an/an/a



Genentech, Inc.; Constellation Pharmaceuticals Inc.

US Patent


Assay Description
His/Flag epitope tagged BRD4 BD142-168 was cloned, expressed, and purified to. BRD4 binding and inhibition was assessed by monitoring the engagement ...


US Patent US10150767 (2018)

More data for this
Ligand-Target Pair