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BDBM50101865 (E)-7-{(1R,2R,3R,5R)-5-Chloro-3-hydroxy-2-[(E)-(S)-3-hydroxy-4-(4-hydroxy-3-methyl-phenyl)-but-1-enyl]-cyclopentyl}-hept-5-enoic acid::CHEMBL63061

SMILES: Cc1cc(C[C@H](O)\C=C\[C@H]2[C@H](O)C[C@@H](Cl)[C@@H]2C\C=C\CCCC(O)=O)ccc1O

InChI Key: InChIKey=RVZYLDOSYAWBKP-CNMKTADYSA-N

Data: 5 KI  1 EC50

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 6 hits for monomerid = 50101865   
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
Prostanoid EP4 receptor


(Mus musculus (Mouse))
BDBM50101865
PNG
((E)-7-{(1R,2R,3R,5R)-5-Chloro-3-hydroxy-2-[(E)-(S)...)
Show SMILES Cc1cc(C[C@H](O)\C=C\[C@H]2[C@H](O)C[C@@H](Cl)[C@@H]2C\C=C\CCCC(O)=O)ccc1O
Show InChI InChI=1S/C23H31ClO5/c1-15-12-16(8-11-21(15)26)13-17(25)9-10-19-18(20(24)14-22(19)27)6-4-2-3-5-7-23(28)29/h2,4,8-12,17-20,22,25-27H,3,5-7,13-14H2,1H3,(H,28,29)/b4-2+,10-9+/t17-,18-,19-,20-,22-/m1/s1
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7.70n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Affinity for mouse Prostanoid EP4 receptor expressed in CHO cells


Bioorg Med Chem Lett 11: 2033-5 (2001)


BindingDB Entry DOI: 10.7270/Q24B30K2
More data for this
Ligand-Target Pair
Prostanoid EP2 Receptor


(Mus musculus (Mouse))
BDBM50101865
PNG
((E)-7-{(1R,2R,3R,5R)-5-Chloro-3-hydroxy-2-[(E)-(S)...)
Show SMILES Cc1cc(C[C@H](O)\C=C\[C@H]2[C@H](O)C[C@@H](Cl)[C@@H]2C\C=C\CCCC(O)=O)ccc1O
Show InChI InChI=1S/C23H31ClO5/c1-15-12-16(8-11-21(15)26)13-17(25)9-10-19-18(20(24)14-22(19)27)6-4-2-3-5-7-23(28)29/h2,4,8-12,17-20,22,25-27H,3,5-7,13-14H2,1H3,(H,28,29)/b4-2+,10-9+/t17-,18-,19-,20-,22-/m1/s1
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PubMed
290n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Affinity for mouse Prostanoid EP2 receptor expressed in CHO cells


Bioorg Med Chem Lett 11: 2033-5 (2001)


BindingDB Entry DOI: 10.7270/Q24B30K2
More data for this
Ligand-Target Pair
Prostanoid EP3 Receptor


(Mus musculus (Mouse))
BDBM50101865
PNG
((E)-7-{(1R,2R,3R,5R)-5-Chloro-3-hydroxy-2-[(E)-(S)...)
Show SMILES Cc1cc(C[C@H](O)\C=C\[C@H]2[C@H](O)C[C@@H](Cl)[C@@H]2C\C=C\CCCC(O)=O)ccc1O
Show InChI InChI=1S/C23H31ClO5/c1-15-12-16(8-11-21(15)26)13-17(25)9-10-19-18(20(24)14-22(19)27)6-4-2-3-5-7-23(28)29/h2,4,8-12,17-20,22,25-27H,3,5-7,13-14H2,1H3,(H,28,29)/b4-2+,10-9+/t17-,18-,19-,20-,22-/m1/s1
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2.20E+3n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Affinity for mouse Prostanoid EP3 receptor expressed in CHO cells


Bioorg Med Chem Lett 11: 2033-5 (2001)


BindingDB Entry DOI: 10.7270/Q24B30K2
More data for this
Ligand-Target Pair
Prostanoid EP1 Receptor


(Mus musculus (Mouse))
BDBM50101865
PNG
((E)-7-{(1R,2R,3R,5R)-5-Chloro-3-hydroxy-2-[(E)-(S)...)
Show SMILES Cc1cc(C[C@H](O)\C=C\[C@H]2[C@H](O)C[C@@H](Cl)[C@@H]2C\C=C\CCCC(O)=O)ccc1O
Show InChI InChI=1S/C23H31ClO5/c1-15-12-16(8-11-21(15)26)13-17(25)9-10-19-18(20(24)14-22(19)27)6-4-2-3-5-7-23(28)29/h2,4,8-12,17-20,22,25-27H,3,5-7,13-14H2,1H3,(H,28,29)/b4-2+,10-9+/t17-,18-,19-,20-,22-/m1/s1
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3.10E+3n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Affinity for mouse Prostanoid EP1 receptor expressed in CHO cells


Bioorg Med Chem Lett 11: 2033-5 (2001)


BindingDB Entry DOI: 10.7270/Q24B30K2
More data for this
Ligand-Target Pair
Prostanoid IP receptor


(Homo sapiens (Human))
BDBM50101865
PNG
((E)-7-{(1R,2R,3R,5R)-5-Chloro-3-hydroxy-2-[(E)-(S)...)
Show SMILES Cc1cc(C[C@H](O)\C=C\[C@H]2[C@H](O)C[C@@H](Cl)[C@@H]2C\C=C\CCCC(O)=O)ccc1O
Show InChI InChI=1S/C23H31ClO5/c1-15-12-16(8-11-21(15)26)13-17(25)9-10-19-18(20(24)14-22(19)27)6-4-2-3-5-7-23(28)29/h2,4,8-12,17-20,22,25-27H,3,5-7,13-14H2,1H3,(H,28,29)/b4-2+,10-9+/t17-,18-,19-,20-,22-/m1/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Affinity for human Prostanoid IP receptor expressed in CHO cells


Bioorg Med Chem Lett 11: 2033-5 (2001)


BindingDB Entry DOI: 10.7270/Q24B30K2
More data for this
Ligand-Target Pair
Prostanoid EP4 Receptor


(Mus musculus (Mouse))
BDBM50101865
PNG
((E)-7-{(1R,2R,3R,5R)-5-Chloro-3-hydroxy-2-[(E)-(S)...)
Show SMILES Cc1cc(C[C@H](O)\C=C\[C@H]2[C@H](O)C[C@@H](Cl)[C@@H]2C\C=C\CCCC(O)=O)ccc1O
Show InChI InChI=1S/C23H31ClO5/c1-15-12-16(8-11-21(15)26)13-17(25)9-10-19-18(20(24)14-22(19)27)6-4-2-3-5-7-23(28)29/h2,4,8-12,17-20,22,25-27H,3,5-7,13-14H2,1H3,(H,28,29)/b4-2+,10-9+/t17-,18-,19-,20-,22-/m1/s1
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PubMed
n/an/an/an/a 44n/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Effective concentration for increased intracellular c-AMP production by mouse Prostanoid EP4 receptor


Bioorg Med Chem Lett 11: 2033-5 (2001)


BindingDB Entry DOI: 10.7270/Q24B30K2
More data for this
Ligand-Target Pair