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BDBM172795 US9096559, 26

SMILES: Nc1ccc(cc1NC(=O)c1ccc(CNC(=O)C2CC2)cc1)-c1ccccc1

InChI Key: InChIKey=NAXDXJNQDIRWFV-UHFFFAOYSA-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 = 172795   
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 1


(Homo sapiens (Human))
BDBM172795
PNG
(US9096559, 26)
Show SMILES Nc1ccc(cc1NC(=O)c1ccc(CNC(=O)C2CC2)cc1)-c1ccccc1
Show InChI InChI=1S/C24H23N3O2/c25-21-13-12-20(17-4-2-1-3-5-17)14-22(21)27-24(29)19-8-6-16(7-9-19)15-26-23(28)18-10-11-18/h1-9,12-14,18H,10-11,15,25H2,(H,26,28)(H,27,29)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

US Patent
n/an/a 15n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Novel compounds were tested for their ability to inhibit histone deacetylase, subtype 1 (HDAC1) using an in vitro deacetylation assay. The enzyme sou...


US Patent US9096559 (2015)


BindingDB Entry DOI: 10.7270/Q2K07317
More data for this
Ligand-Target Pair