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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 = 'BDBM254916'   
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))
BDBM254916
PNG
(US9493483, 404)
Show SMILES Cc1noc(n1)-c1ccc2-c3c(C)noc3[C@H](CC(N)=O)N=C(c3ccc(Cl)cc3)c2c1
Show InChI InChI=1S/C23H18ClN5O3/c1-11-20-16-8-5-14(23-26-12(2)29-32-23)9-17(16)21(13-3-6-15(24)7-4-13)27-18(10-19(25)30)22(20)31-28-11/h3-9,18H,10H2,1-2H3,(H2,25,30)/t18-/m0/s1
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 270n/an/an/an/a7.025



Constellation Pharmaceuticals, Inc.

US Patent


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


US Patent US9493483 (2016)


BindingDB Entry DOI: 10.7270/Q26D5RXQ
More data for this
Ligand-Target Pair