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BDBM94594 2-(1-benzofuran-2-yl)-N-cyclohexyl-2-[3-(furan-2-yl)-2-oxidanylidene-quinoxalin-1-yl]ethanamide::2-(1-benzofuran-2-yl)-N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]acetamide::2-(2-benzofuranyl)-N-cyclohexyl-2-[3-(2-furanyl)-2-oxo-1-quinoxalinyl]acetamide::2-(benzofuran-2-yl)-N-cyclohexyl-2-[3-(2-furyl)-2-keto-quinoxalin-1-yl]acetamide::MLS003674202::SMR002353670::cid_53383327

SMILES: O=C(NC1CCCCC1)C(c1cc2ccccc2o1)n1c2ccccc2nc(-c2ccco2)c1=O

InChI Key: InChIKey=KMZVPYBFECAAEE-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 = 94594   
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))
BDBM94594
PNG
(2-(1-benzofuran-2-yl)-N-cyclohexyl-2-[3-(furan-2-y...)
Show SMILES O=C(NC1CCCCC1)C(c1cc2ccccc2o1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C28H25N3O4/c32-27(29-19-10-2-1-3-11-19)26(24-17-18-9-4-7-14-22(18)35-24)31-21-13-6-5-12-20(21)30-25(28(31)33)23-15-8-16-34-23/h4-9,12-17,19,26H,1-3,10-11H2,(H,29,32)
PDB
MMDB

NCI pathway
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UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

PCBioAssay
n/an/a 2.19E+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))
BDBM94594
PNG
(2-(1-benzofuran-2-yl)-N-cyclohexyl-2-[3-(furan-2-y...)
Show SMILES O=C(NC1CCCCC1)C(c1cc2ccccc2o1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C28H25N3O4/c32-27(29-19-10-2-1-3-11-19)26(24-17-18-9-4-7-14-22(18)35-24)31-21-13-6-5-12-20(21)30-25(28(31)33)23-15-8-16-34-23/h4-9,12-17,19,26H,1-3,10-11H2,(H,29,32)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.36E+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/Q24B2ZW9
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94594
PNG
(2-(1-benzofuran-2-yl)-N-cyclohexyl-2-[3-(furan-2-y...)
Show SMILES O=C(NC1CCCCC1)C(c1cc2ccccc2o1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C28H25N3O4/c32-27(29-19-10-2-1-3-11-19)26(24-17-18-9-4-7-14-22(18)35-24)31-21-13-6-5-12-20(21)30-25(28(31)33)23-15-8-16-34-23/h4-9,12-17,19,26H,1-3,10-11H2,(H,29,32)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.29E+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