BindingDB logo
myBDB logout

BDBM37625 (4Z)-1-(2-furfuryl)-4-[hydroxy(m-phenetyl)methylene]-5-(4-pyridyl)pyrrolidine-2,3-quinone::(4Z)-4-[(3-ethoxyphenyl)-hydroxymethylidene]-1-(2-furanylmethyl)-5-pyridin-4-ylpyrrolidine-2,3-dione::(4Z)-4-[(3-ethoxyphenyl)-hydroxymethylidene]-1-(furan-2-ylmethyl)-5-pyridin-4-ylpyrrolidine-2,3-dione::(4Z)-4-[(3-ethoxyphenyl)-oxidanyl-methylidene]-1-(furan-2-ylmethyl)-5-pyridin-4-yl-pyrrolidine-2,3-dione::4-(3-Ethoxy-benzoyl)-1-furan-2-ylmethyl-3-hydroxy-5-pyridin-4-yl-1,5-dihydro-pyrrol-2-one::MLS000033794::SMR000013592::cid_6398932

SMILES: CCOc1cccc(c1)C(=O)C1C(N(Cc2ccco2)C(=O)C1=O)c1ccncc1

InChI Key: InChIKey=ITHQFKJEPAIUPC-UHFFFAOYSA-N

Data: 2 KI  2 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 = 37625   
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
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM37625
PNG
((4Z)-1-(2-furfuryl)-4-[hydroxy(m-phenetyl)methylen...)
Show SMILES CCOc1cccc(c1)C(=O)C1C(N(Cc2ccco2)C(=O)C1=O)c1ccncc1
Show InChI InChI=1S/C23H20N2O5/c1-2-29-17-6-3-5-16(13-17)21(26)19-20(15-8-10-24-11-9-15)25(23(28)22(19)27)14-18-7-4-12-30-18/h3-13,19-20H,2,14H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
>4.03E+4n/an/an/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph....


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2DF6PMF
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor


(Homo sapiens (Human))
BDBM37625
PNG
((4Z)-1-(2-furfuryl)-4-[hydroxy(m-phenetyl)methylen...)
Show SMILES CCOc1cccc(c1)C(=O)C1C(N(Cc2ccco2)C(=O)C1=O)c1ccncc1
Show InChI InChI=1S/C23H20N2O5/c1-2-29-17-6-3-5-16(13-17)21(26)19-20(15-8-10-24-11-9-15)25(23(28)22(19)27)14-18-7-4-12-30-18/h3-13,19-20H,2,14H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
>4.37E+4n/an/an/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2NZ862K
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM37625
PNG
((4Z)-1-(2-furfuryl)-4-[hydroxy(m-phenetyl)methylen...)
Show SMILES CCOc1cccc(c1)C(=O)C1C(N(Cc2ccco2)C(=O)C1=O)c1ccncc1
Show InChI InChI=1S/C23H20N2O5/c1-2-29-17-6-3-5-16(13-17)21(26)19-20(15-8-10-24-11-9-15)25(23(28)22(19)27)14-18-7-4-12-30-18/h3-13,19-20H,2,14H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>6.67E+4n/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph....


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2DF6PMF
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor


(Homo sapiens (Human))
BDBM37625
PNG
((4Z)-1-(2-furfuryl)-4-[hydroxy(m-phenetyl)methylen...)
Show SMILES CCOc1cccc(c1)C(=O)C1C(N(Cc2ccco2)C(=O)C1=O)c1ccncc1
Show InChI InChI=1S/C23H20N2O5/c1-2-29-17-6-3-5-16(13-17)21(26)19-20(15-8-10-24-11-9-15)25(23(28)22(19)27)14-18-7-4-12-30-18/h3-13,19-20H,2,14H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>6.67E+4n/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2J67FB5
More data for this
Ligand-Target Pair