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BDBM215765 US9296748, III-6

SMILES: CCCOc1ccc2nc(-c3cc(C)c(=O)n(C)c3)n([C@@H](C)c3ccccc3)c2n1

InChI Key: InChIKey=AUTYESUULAZCIX-KRWDZBQOSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 215765   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Bromodomain-containing protein 4 (BRD4) (aa 44-168)


(Homo sapiens (Human))
BDBM215765
PNG
(US9296748, III-6)
Show SMILES CCCOc1ccc2nc(-c3cc(C)c(=O)n(C)c3)n([C@@H](C)c3ccccc3)c2n1 |r|
Show InChI InChI=1S/C24H26N4O2/c1-5-13-30-21-12-11-20-23(26-21)28(17(3)18-9-7-6-8-10-18)22(25-20)19-14-16(2)24(29)27(4)15-19/h6-12,14-15,17H,5,13H2,1-4H3/t17-/m0/s1
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 108n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Compounds are diluted in serial dilution 1:5 in assay buffer from 10 mM stock in DMSO (100 μM start concentration) in white OptiPlate-384 (Perki...


US Patent US9296748 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K4K
More data for this
Ligand-Target Pair