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BDBM124188 US8748451, 3::US8748451, 7

SMILES: CN1CCc2c(C1)n(CCCCCC(=O)NO)c1ccccc21

InChI Key: InChIKey=IPGBKSUNOKDFQM-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 124188   
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))
BDBM124188
PNG
(US8748451, 3 | US8748451, 7)
Show SMILES CN1CCc2c(C1)n(CCCCCC(=O)NO)c1ccccc21
Show InChI InChI=1S/C18H25N3O2/c1-20-12-10-15-14-7-4-5-8-16(14)21(17(15)13-20)11-6-2-3-9-18(22)19-23/h4-5,7-8,23H,2-3,6,9-13H2,1H3,(H,19,22)
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>3.00E+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
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM124188
PNG
(US8748451, 3 | US8748451, 7)
Show SMILES CN1CCc2c(C1)n(CCCCCC(=O)NO)c1ccccc21
Show InChI InChI=1S/C18H25N3O2/c1-20-12-10-15-14-7-4-5-8-16(14)21(17(15)13-20)11-6-2-3-9-18(22)19-23/h4-5,7-8,23H,2-3,6,9-13H2,1H3,(H,19,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
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antibodypedia
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AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.40n/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
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM124188
PNG
(US8748451, 3 | US8748451, 7)
Show SMILES CN1CCc2c(C1)n(CCCCCC(=O)NO)c1ccccc21
Show InChI InChI=1S/C18H25N3O2/c1-20-12-10-15-14-7-4-5-8-16(14)21(17(15)13-20)11-6-2-3-9-18(22)19-23/h4-5,7-8,23H,2-3,6,9-13H2,1H3,(H,19,22)
PDB
MMDB

NCI pathway
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KEGG

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antibodypedia
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PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 550n/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))
BDBM124188
PNG
(US8748451, 3 | US8748451, 7)
Show SMILES CN1CCc2c(C1)n(CCCCCC(=O)NO)c1ccccc21
Show InChI InChI=1S/C18H25N3O2/c1-20-12-10-15-14-7-4-5-8-16(14)21(17(15)13-20)11-6-2-3-9-18(22)19-23/h4-5,7-8,23H,2-3,6,9-13H2,1H3,(H,19,22)
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 5.18E+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