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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone acetyltransferase KAT6B' and Ligand = 'BDBM50518832'   
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 KAT6B


(Homo sapiens)
BDBM50518832
PNG
(CHEMBL4455897 | US10829446, Compound 36)
Show SMILES Cc1cc(cc(C(=O)NNS(=O)(=O)c2ccccc2)c1F)-c1ccccc1
Show InChI InChI=1S/C20H17FN2O3S/c1-14-12-16(15-8-4-2-5-9-15)13-18(19(14)21)20(24)22-23-27(25,26)17-10-6-3-7-11-17/h2-13,23H,1H3,(H,22,24)
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MCE
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a 28n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of KAT6B (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
Histone acetyltransferase KAT6B


(Homo sapiens)
BDBM50518832
PNG
(CHEMBL4455897 | US10829446, Compound 36)
Show SMILES Cc1cc(cc(C(=O)NNS(=O)(=O)c2ccccc2)c1F)-c1ccccc1
Show InChI InChI=1S/C20H17FN2O3S/c1-14-12-16(15-8-4-2-5-9-15)13-18(19(14)21)20(24)22-23-27(25,26)17-10-6-3-7-11-17/h2-13,23H,1H3,(H,22,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
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MCE
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a 28n/an/an/an/an/an/a



Cancer Therapeutics CRC

Curated by ChEMBL


Assay Description
Inhibition of N-terminal GST-tagged recombinant human KAT6B (431 to end residues) expressed in baculovirus infected Sf9 insect cells using acetyl coe...


J Med Chem 62: 7146-7159 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00665
BindingDB Entry DOI: 10.7270/Q26D5XCM
More data for this
Ligand-Target Pair