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BDBM94514 MLS003674206::N-cyclohexyl-2-[3-(2-furanyl)-2-oxo-1-quinoxalinyl]-2-(1-naphthalenyl)acetamide::N-cyclohexyl-2-[3-(2-furyl)-2-keto-quinoxalin-1-yl]-2-(1-naphthyl)acetamide::N-cyclohexyl-2-[3-(furan-2-yl)-2-oxidanylidene-quinoxalin-1-yl]-2-naphthalen-1-yl-ethanamide::N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-naphthalen-1-ylacetamide::SMR002353674::cid_53383331

SMILES: O=C(NC1CCCCC1)C(c1cccc2ccccc12)n1c2ccccc2nc(-c2ccco2)c1=O

InChI Key: InChIKey=BHQOILQQNYFTMM-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 94514   
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
Hepatocyte nuclear factor 4-alpha


(Homo sapiens (Human))
BDBM94514
PNG
(MLS003674206 | N-cyclohexyl-2-[3-(2-furanyl)-2-oxo...)
Show SMILES O=C(NC1CCCCC1)C(c1cccc2ccccc12)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C30H27N3O3/c34-29(31-21-12-2-1-3-13-21)28(23-15-8-11-20-10-4-5-14-22(20)23)33-25-17-7-6-16-24(25)32-27(30(33)35)26-18-9-19-36-26/h4-11,14-19,21,28H,1-3,12-13H2,(H,31,34)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

PCBioAssay
n/an/a 1.48E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2736PH3
More data for this
Ligand-Target Pair
Perilipin-5


(Homo sapiens (Human))
BDBM94514
PNG
(MLS003674206 | N-cyclohexyl-2-[3-(2-furanyl)-2-oxo...)
Show SMILES O=C(NC1CCCCC1)C(c1cccc2ccccc12)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C30H27N3O3/c34-29(31-21-12-2-1-3-13-21)28(23-15-8-11-20-10-4-5-14-22(20)23)33-25-17-7-6-16-24(25)32-27(30(33)35)26-18-9-19-36-26/h4-11,14-19,21,28H,1-3,12-13H2,(H,31,34)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 940n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q24B2ZW9
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94514
PNG
(MLS003674206 | N-cyclohexyl-2-[3-(2-furanyl)-2-oxo...)
Show SMILES O=C(NC1CCCCC1)C(c1cccc2ccccc12)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C30H27N3O3/c34-29(31-21-12-2-1-3-13-21)28(23-15-8-11-20-10-4-5-14-22(20)23)33-25-17-7-6-16-24(25)32-27(30(33)35)26-18-9-19-36-26/h4-11,14-19,21,28H,1-3,12-13H2,(H,31,34)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.22E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair