BindingDB logo
myBDB logout

BDBM50159771 (E)-3-{2-[(E)-3-(2-Hydroxy-3-methyl-phenyl)-allyl]-phenyl}-acrylic acid::CHEMBL180389

SMILES: Cc1cccc(\C=C\Cc2ccccc2\C=C\C(O)=O)c1O

InChI Key: InChIKey=ZYHACJLUMNSJHB-JEWGOZGESA-N

Data: 4 KI

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 = 50159771   
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
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50159771
PNG
((E)-3-{2-[(E)-3-(2-Hydroxy-3-methyl-phenyl)-allyl]...)
Show SMILES Cc1cccc(\C=C\Cc2ccccc2\C=C\C(O)=O)c1O
Show InChI InChI=1S/C19H18O3/c1-14-6-4-10-17(19(14)22)11-5-9-15-7-2-3-8-16(15)12-13-18(20)21/h2-8,10-13,22H,9H2,1H3,(H,20,21)/b11-5+,13-12+
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
10n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Binding affinity for human prostanoid EP3 receptor


Bioorg Med Chem Lett 15: 527-30 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.051
BindingDB Entry DOI: 10.7270/Q26H4J51
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50159771
PNG
((E)-3-{2-[(E)-3-(2-Hydroxy-3-methyl-phenyl)-allyl]...)
Show SMILES Cc1cccc(\C=C\Cc2ccccc2\C=C\C(O)=O)c1O
Show InChI InChI=1S/C19H18O3/c1-14-6-4-10-17(19(14)22)11-5-9-15-7-2-3-8-16(15)12-13-18(20)21/h2-8,10-13,22H,9H2,1H3,(H,20,21)/b11-5+,13-12+
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.60E+3n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Binding affinity for human prostanoid EP4 receptor


Bioorg Med Chem Lett 15: 527-30 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.051
BindingDB Entry DOI: 10.7270/Q26H4J51
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50159771
PNG
((E)-3-{2-[(E)-3-(2-Hydroxy-3-methyl-phenyl)-allyl]...)
Show SMILES Cc1cccc(\C=C\Cc2ccccc2\C=C\C(O)=O)c1O
Show InChI InChI=1S/C19H18O3/c1-14-6-4-10-17(19(14)22)11-5-9-15-7-2-3-8-16(15)12-13-18(20)21/h2-8,10-13,22H,9H2,1H3,(H,20,21)/b11-5+,13-12+
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
7.30E+3n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Binding affinity for human prostanoid EP2 receptor


Bioorg Med Chem Lett 15: 527-30 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.051
BindingDB Entry DOI: 10.7270/Q26H4J51
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype (EP1)


(Homo sapiens (Human))
BDBM50159771
PNG
((E)-3-{2-[(E)-3-(2-Hydroxy-3-methyl-phenyl)-allyl]...)
Show SMILES Cc1cccc(\C=C\Cc2ccccc2\C=C\C(O)=O)c1O
Show InChI InChI=1S/C19H18O3/c1-14-6-4-10-17(19(14)22)11-5-9-15-7-2-3-8-16(15)12-13-18(20)21/h2-8,10-13,22H,9H2,1H3,(H,20,21)/b11-5+,13-12+
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
6.80E+4n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Binding affinity for human prostanoid EP1 receptor


Bioorg Med Chem Lett 15: 527-30 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.051
BindingDB Entry DOI: 10.7270/Q26H4J51
More data for this
Ligand-Target Pair