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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Prostaglandin E2 receptor EP4 subtype' and Ligand = 'BDBM50101847'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Prostaglandin E2 receptor EP4 subtype


(Mus musculus (Mouse))
BDBM50101847
PNG
(CHEMBL305568 | {3-[(1R,2S,3R)-3-Hydroxy-2-((E)-(S)...)
Show SMILES Cc1cccc(C[C@H](O)\C=C\[C@H]2[C@H](O)CC(=O)[C@@H]2SCCCSCC(O)=O)c1
Show InChI InChI=1S/C21H28O5S2/c1-14-4-2-5-15(10-14)11-16(22)6-7-17-18(23)12-19(24)21(17)28-9-3-8-27-13-20(25)26/h2,4-7,10,16-18,21-23H,3,8-9,11-13H2,1H3,(H,25,26)/b7-6+/t16-,17+,18-,21-/m1/s1
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PC cid
PC sid
UniChem

Similars

PubMed
1.90n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Evaluated for its competitive binding affinity towards mouse Prostanoid EP4 receptor in CHO cells expressing prostanoid receptor


Bioorg Med Chem Lett 11: 2029-31 (2001)


BindingDB Entry DOI: 10.7270/Q2833R9D
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Mus musculus (Mouse))
BDBM50101847
PNG
(CHEMBL305568 | {3-[(1R,2S,3R)-3-Hydroxy-2-((E)-(S)...)
Show SMILES Cc1cccc(C[C@H](O)\C=C\[C@H]2[C@H](O)CC(=O)[C@@H]2SCCCSCC(O)=O)c1
Show InChI InChI=1S/C21H28O5S2/c1-14-4-2-5-15(10-14)11-16(22)6-7-17-18(23)12-19(24)21(17)28-9-3-8-27-13-20(25)26/h2,4-7,10,16-18,21-23H,3,8-9,11-13H2,1H3,(H,25,26)/b7-6+/t16-,17+,18-,21-/m1/s1
PDB

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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 2.80n/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Effective concentration which increases intracellular c-AMP production in mouse Prostanoid EP4 receptor


Bioorg Med Chem Lett 11: 2029-31 (2001)


BindingDB Entry DOI: 10.7270/Q2833R9D
More data for this
Ligand-Target Pair