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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone acetyltransferase GCN5' and Ligand = 'BDBM50076324'   
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
Histone acetyltransferase GCN5


(Saccharomyces cerevisiae S288c)
BDBM50076324
PNG
(CHEMBL3416332)
Show SMILES Cn1c(CN2CCOCC2)nnc1Sc1ccc([N+]([O-])=O)c2nonc12
Show InChI InChI=1S/C14H15N7O4S/c1-19-11(8-20-4-6-24-7-5-20)15-16-14(19)26-10-3-2-9(21(22)23)12-13(10)18-25-17-12/h2-3H,4-8H2,1H3
PDB

UniProtKB/SwissProt

B.MOAD
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.80E+3n/an/an/an/an/an/a



Mayo Clinic College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of Vps75-stimulated recombinant Saccharomyces cerevisiae histone acetyltransferase Rtt109 using Asf1-dH3-H4 as substrate assessed as coenz...


J Med Chem 58: 2091-113 (2015)


Article DOI: 10.1021/jm5019093
BindingDB Entry DOI: 10.7270/Q26M38J9
More data for this
Ligand-Target Pair
Histone acetyltransferase GCN5


(Saccharomyces cerevisiae S288c)
BDBM50076324
PNG
(CHEMBL3416332)
Show SMILES Cn1c(CN2CCOCC2)nnc1Sc1ccc([N+]([O-])=O)c2nonc12
Show InChI InChI=1S/C14H15N7O4S/c1-19-11(8-20-4-6-24-7-5-20)15-16-14(19)26-10-3-2-9(21(22)23)12-13(10)18-25-17-12/h2-3H,4-8H2,1H3
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.70E+3n/an/an/an/an/an/a



Mayo Clinic College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of Vps75-stimulated recombinant Saccharomyces cerevisiae histone acetyltransferase Rtt109 using Asf1-dH3-H4 as substrate assessed as coenz...


J Med Chem 58: 2091-113 (2015)


Article DOI: 10.1021/jm5019093
BindingDB Entry DOI: 10.7270/Q26M38J9
More data for this
Ligand-Target Pair