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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 = 'BDBM321355'   
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))
BDBM321355
PNG
(4-(6-but-2-enyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-y...)
Show SMILES CC=CCn1cc(-c2ccc(cc2)C(=O)NC2CC2)c2cc[nH]c2c1=O
Show InChI InChI=1S/C21H21N3O2/c1-2-3-12-24-13-18(17-10-11-22-19(17)21(24)26)14-4-6-15(7-5-14)20(25)23-16-8-9-16/h2-7,10-11,13,16,22H,8-9,12H2,1H3,(H,23,25)/b3-2+
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 510n/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