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BDBM50539787 CHEMBL4634252

SMILES: Cn1cc(-c2cc(NS(C)(=O)=O)cc3ccn(Cc4ccc(F)cc4)c23)c2cc[nH]c(=O)c12

InChI Key: InChIKey=WPUPAOCVMFTOLI-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50539787   
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


(Homo sapiens (Human))
BDBM50539787
PNG
(CHEMBL4634252)
Show SMILES Cn1cc(-c2cc(NS(C)(=O)=O)cc3ccn(Cc4ccc(F)cc4)c23)c2cc[nH]c(=O)c12
Show InChI InChI=1S/C24H21FN4O3S/c1-28-14-21(19-7-9-26-24(30)23(19)28)20-12-18(27-33(2,31)32)11-16-8-10-29(22(16)20)13-15-3-5-17(25)6-4-15/h3-12,14,27H,13H2,1-2H3,(H,26,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a 1.18E+3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Displacement of APC-labeled biotinylated-avidin from Euphorium-chelated recombinant human BRD4 bromodomain 1 expressed in Escherichia coli preincubat...


J Med Chem 63: 7186-7210 (2020)

More data for this
Ligand-Target Pair