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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 = 'BDBM321345'   
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))
BDBM321345
PNG
(3-[6-(cyclohexylmethyl)-7-oxo-1H-pyrrolo[2,3-c]pyr...)
Show SMILES CN(C)C(=O)c1cccc(c1)-c1cn(CC2CCCCC2)c(=O)c2[nH]ccc12
Show InChI InChI=1S/C23H27N3O2/c1-25(2)22(27)18-10-6-9-17(13-18)20-15-26(14-16-7-4-3-5-8-16)23(28)21-19(20)11-12-24-21/h6,9-13,15-16,24H,3-5,7-8,14H2,1-2H3
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 1.50E+4n/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 homogeneity. BRD4 binding and inhibition was assessed by monitoring the...


US Patent US10183009 (2019)

More data for this
Ligand-Target Pair