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SMILES: ONC(=O)CCCCn1c2ccccc2c2ccccc12

InChI Key: InChIKey=AQDDIRQJXQPFCW-UHFFFAOYSA-N

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 2 hits for monomerid = 124193   
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 6


(Homo sapiens (Human))
BDBM124193
PNG
(US8748451, 9)
Show SMILES ONC(=O)CCCCn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C17H18N2O2/c20-17(18-21)11-5-6-12-19-15-9-3-1-7-13(15)14-8-2-4-10-16(14)19/h1-4,7-10,21H,5-6,11-12H2,(H,18,20)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2.63E+3n/an/an/an/a8.025



The Board of Trustees of The University of Illinois

US Patent


Assay Description
HDAC assay is performed using fluorescently-labeled acetylated substrate, which comprises an acetylated lysine side chain. After incubation with HDAC...


US Patent US8748451 (2014)


BindingDB Entry DOI: 10.7270/Q26D5RPK
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM124193
PNG
(US8748451, 9)
Show SMILES ONC(=O)CCCCn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C17H18N2O2/c20-17(18-21)11-5-6-12-19-15-9-3-1-7-13(15)14-8-2-4-10-16(14)19/h1-4,7-10,21H,5-6,11-12H2,(H,18,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

US Patent
n/an/a 1.28E+4n/an/an/an/a8.025



The Board of Trustees of The University of Illinois

US Patent


Assay Description
HDAC assay is performed using fluorescently-labeled acetylated substrate, which comprises an acetylated lysine side chain. After incubation with HDAC...


US Patent US8748451 (2014)


BindingDB Entry DOI: 10.7270/Q26D5RPK
More data for this
Ligand-Target Pair