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BDBM333454 US9737525, Compound MIND4-2

SMILES: Clc1ccc(cc1)-n1c(COc2cccc3ccccc23)nnc1SCc1ccccc1

InChI Key: InChIKey=FMHNUNANOGQTFT-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 333454   
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))
BDBM333454
PNG
(US9737525, Compound MIND4-2)
Show SMILES Clc1ccc(cc1)-n1c(COc2cccc3ccccc23)nnc1SCc1ccccc1
Show InChI InChI=1S/C26H20ClN3OS/c27-21-13-15-22(16-14-21)30-25(28-29-26(30)32-18-19-7-2-1-3-8-19)17-31-24-12-6-10-20-9-4-5-11-23(20)24/h1-16H,17-18H2
PDB
MMDB

NCI pathway
KEGG

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 1.20E+4n/an/an/an/an/an/a



The General Hospital Corporation; The Regents of the University of California

US Patent


Assay Description
Modulation of sirtuin activity by compounds was assessed using the Flour de Lys fluorescent biochemical assay in a 96-well format as described (Outei...


US Patent US9737525 (2017)

More data for this
Ligand-Target Pair