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BDBM120954 US8716285, 11

SMILES: Cc1ccc(cc1)-c1ccnc(NC2CCc3ccc(cc3C2)C(=O)NO)n1

InChI Key: InChIKey=JMHNLZDULQUHPT-UHFFFAOYNA-N

Data: 1 IC50

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   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 = 120954   
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
Histone deacetylase 8


(Homo sapiens (Human))
BDBM120954
PNG
(US8716285, 11)
Show SMILES Cc1ccc(cc1)-c1ccnc(NC2CCc3ccc(cc3C2)C(=O)NO)n1
Show InChI InChI=1/C22H22N4O2/c1-14-2-4-16(5-3-14)20-10-11-23-22(25-20)24-19-9-8-15-6-7-17(21(27)26-28)12-18(15)13-19/h2-7,10-12,19,28H,8-9,13H2,1H3,(H,26,27)(H,23,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 800n/an/an/an/an/an/a



Hoffmann-La Roche Inc

US Patent


Assay Description
Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...


US Patent US8716285 (2014)


BindingDB Entry DOI: 10.7270/Q2K072XG
More data for this
Ligand-Target Pair