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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'NAD-dependent protein deacylase sirtuin-6' and Ligand = 'BDBM50540059'   
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
NAD-dependent protein deacylase sirtuin-6


(Homo sapiens (Human))		BDBM50540059
PNG
(CHEMBL4645806)
Show SMILES CCCCCCCCCCCCCC(=O)NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)O)C(O)=O |r|
Show InChI InChI=1S/C35H64N6O9/c1-4-5-6-7-8-9-10-11-12-13-14-20-29(44)37-21-16-15-18-26(38-33(47)28-19-17-22-41(28)34(48)24(2)36)31(45)39-27(23-42)32(46)40-30(25(3)43)35(49)50/h24-28,30,42-43H,4-23,36H2,1-3H3,(H,37,44)(H,38,47)(H,39,45)(H,40,46)(H,49,50)/t24-,25+,26-,27-,28-,30-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of sirtuin 6 (unknown origin)

Eur J Med Chem 161: 48-77 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.028
BindingDB Entry DOI: 10.7270/Q2W380VZ
More data for this
Ligand-Target Pair