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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone acetyltransferase p300' and Ligand = 'BDBM50528254'   
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 p300


(Homo sapiens (Human))
BDBM50528254
PNG
(CHEMBL4515219)
Show SMILES CCOC(=O)c1cc2cc(OCCCCCNCC#C)ccc2nc1C
Show InChI InChI=1S/C21H26N2O3/c1-4-11-22-12-7-6-8-13-26-18-9-10-20-17(14-18)15-19(16(3)23-20)21(24)25-5-2/h1,9-10,14-15,22H,5-8,11-13H2,2-3H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.75E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human P300 (1284 to1673 residues) catalytic domain using histone H3 and [acetyl-3H]-acetylcoenzyme A as substrate incubated for 1 hr by...


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112861
BindingDB Entry DOI: 10.7270/Q2CC14D7
More data for this
Ligand-Target Pair
Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50528254
PNG
(CHEMBL4515219)
Show SMILES CCOC(=O)c1cc2cc(OCCCCCNCC#C)ccc2nc1C
Show InChI InChI=1S/C21H26N2O3/c1-4-11-22-12-7-6-8-13-26-18-9-10-20-17(14-18)15-19(16(3)23-20)21(24)25-5-2/h1,9-10,14-15,22H,5-8,11-13H2,2-3H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.75E+4n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of P300 (unknown origin)


Eur J Med Chem 178: 259-286 (2019)


Article DOI: 10.1016/j.ejmech.2019.05.078
BindingDB Entry DOI: 10.7270/Q2ZW1QC8
More data for this
Ligand-Target Pair