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BDBM50508323 CHEMBL4544653

SMILES: Cc1cc(cnn1)-c1ccc(C)c(c1)S(=O)(=O)NC1CCCC1

InChI Key: InChIKey=FGIHJNWTWCXSLO-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50508323   
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))
BDBM50508323
PNG
(CHEMBL4544653)
Show SMILES Cc1cc(cnn1)-c1ccc(C)c(c1)S(=O)(=O)NC1CCCC1
Show InChI InChI=1S/C17H21N3O2S/c1-12-7-8-14(15-9-13(2)19-18-11-15)10-17(12)23(21,22)20-16-5-3-4-6-16/h7-11,16,20H,3-6H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.94E+3n/an/an/an/an/an/a



Gilead Sciences, Inc.

Curated by ChEMBL


Assay Description
Inhibition of biotin-labelled tetra-acetylated Histone H4 peptide binding to recombinant human N-terminal TEV-cleavable hexa-histidine tagged BRD4 br...


Bioorg Med Chem 27: 457-469 (2019)


Article DOI: 10.1016/j.bmc.2018.11.020
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50508323
PNG
(CHEMBL4544653)
Show SMILES Cc1cc(cnn1)-c1ccc(C)c(c1)S(=O)(=O)NC1CCCC1
Show InChI InChI=1S/C17H21N3O2S/c1-12-7-8-14(15-9-13(2)19-18-11-15)10-17(12)23(21,22)20-16-5-3-4-6-16/h7-11,16,20H,3-6H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.63E+4n/an/an/an/an/an/a



Gilead Sciences, Inc.

Curated by ChEMBL


Assay Description
Inhibition of biotin-labelled tetra-acetylated Histone H4 peptide binding to recombinant human N-terminal TEV-cleavable hexa-histidine tagged BRD4 br...


Bioorg Med Chem 27: 457-469 (2019)


Article DOI: 10.1016/j.bmc.2018.11.020
More data for this
Ligand-Target Pair