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BDBM50070593 CHEMBL3408833

SMILES: CCCCCCCCn1c2CCN(C)Cc2c2cc(ccc12)-c1cnc(N)nc1

InChI Key: InChIKey=FLKHSDLVKPSLIK-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 = 50070593   
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
NAD-dependent deacetylase sirtuin 2


(Homo sapiens (Human))
BDBM50070593
PNG
(CHEMBL3408833)
Show SMILES CCCCCCCCn1c2CCN(C)Cc2c2cc(ccc12)-c1cnc(N)nc1
Show InChI InChI=1S/C24H33N5/c1-3-4-5-6-7-8-12-29-22-10-9-18(19-15-26-24(25)27-16-19)14-20(22)21-17-28(2)13-11-23(21)29/h9-10,14-16H,3-8,11-13,17H2,1-2H3,(H2,25,26,27)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.79E+4n/an/an/an/an/an/a



National University of Singapore

Curated by ChEMBL


Assay Description
Inhibition of human recombinant SIRT2 assessed as deacetylation of N-acetyl lysine residue in p53 (317 to 320) after 30 mins by luciferase-mediated l...


Eur J Med Chem 92: 145-55 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.027
BindingDB Entry DOI: 10.7270/Q270834V
More data for this
Ligand-Target Pair
NAD-Dependent Deacetylase Sirtuin-1


(Homo sapiens (Human))
BDBM50070593
PNG
(CHEMBL3408833)
Show SMILES CCCCCCCCn1c2CCN(C)Cc2c2cc(ccc12)-c1cnc(N)nc1
Show InChI InChI=1S/C24H33N5/c1-3-4-5-6-7-8-12-29-22-10-9-18(19-15-26-24(25)27-16-19)14-20(22)21-17-28(2)13-11-23(21)29/h9-10,14-16H,3-8,11-13,17H2,1-2H3,(H2,25,26,27)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



National University of Singapore

Curated by ChEMBL


Assay Description
Inhibition of human recombinant SIRT1 assessed as deacetylation of N-acetyl lysine residue in p53 (317 to 320) after 30 mins by luciferase-mediated l...


Eur J Med Chem 92: 145-55 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.027
BindingDB Entry DOI: 10.7270/Q270834V
More data for this
Ligand-Target Pair