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BDBM50101818 (Z)-7-{(1R,2S,3R)-2-[(E)-(S)-4-(1-Ethyl-cyclobutyl)-4-hydroxy-but-1-enyl]-3-hydroxy-cyclopentyl}-hept-5-enoic acid::CHEMBL64358

SMILES: CCC1(CCC1)[C@@H](O)C\C=C\[C@H]1[C@H](O)CC[C@@H]1C\C=C/CCCC(O)=O

InChI Key: InChIKey=RHDMZEUUDSELOB-MVFPXBJFSA-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 = 50101818   
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 EP2 Receptor


(Mus musculus (Mouse))
BDBM50101818
PNG
((Z)-7-{(1R,2S,3R)-2-[(E)-(S)-4-(1-Ethyl-cyclobutyl...)
Show SMILES CCC1(CCC1)[C@@H](O)C\C=C\[C@H]1[C@H](O)CC[C@@H]1C\C=C/CCCC(O)=O
Show InChI InChI=1S/C22H36O4/c1-2-22(15-8-16-22)20(24)11-7-10-18-17(13-14-19(18)23)9-5-3-4-6-12-21(25)26/h3,5,7,10,17-20,23-24H,2,4,6,8-9,11-16H2,1H3,(H,25,26)/b5-3-,10-7+/t17-,18+,19+,20-/m0/s1
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11n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards mouse Prostanoid EP2 receptor expressed in CHO cells.


Bioorg Med Chem Lett 11: 2025-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CV4H1T
More data for this
Ligand-Target Pair
Prostanoid EP1 Receptor


(Mus musculus (Mouse))
BDBM50101818
PNG
((Z)-7-{(1R,2S,3R)-2-[(E)-(S)-4-(1-Ethyl-cyclobutyl...)
Show SMILES CCC1(CCC1)[C@@H](O)C\C=C\[C@H]1[C@H](O)CC[C@@H]1C\C=C/CCCC(O)=O
Show InChI InChI=1S/C22H36O4/c1-2-22(15-8-16-22)20(24)11-7-10-18-17(13-14-19(18)23)9-5-3-4-6-12-21(25)26/h3,5,7,10,17-20,23-24H,2,4,6,8-9,11-16H2,1H3,(H,25,26)/b5-3-,10-7+/t17-,18+,19+,20-/m0/s1
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5.10E+3n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards mouse Prostanoid EP1 receptor in CHO cells.


Bioorg Med Chem Lett 11: 2025-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CV4H1T
More data for this
Ligand-Target Pair
Prostanoid EP4 Receptor


(Mus musculus (Mouse))
BDBM50101818
PNG
((Z)-7-{(1R,2S,3R)-2-[(E)-(S)-4-(1-Ethyl-cyclobutyl...)
Show SMILES CCC1(CCC1)[C@@H](O)C\C=C\[C@H]1[C@H](O)CC[C@@H]1C\C=C/CCCC(O)=O
Show InChI InChI=1S/C22H36O4/c1-2-22(15-8-16-22)20(24)11-7-10-18-17(13-14-19(18)23)9-5-3-4-6-12-21(25)26/h3,5,7,10,17-20,23-24H,2,4,6,8-9,11-16H2,1H3,(H,25,26)/b5-3-,10-7+/t17-,18+,19+,20-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards mouse Prostanoid EP4 receptor in CHO cells.


Bioorg Med Chem Lett 11: 2025-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CV4H1T
More data for this
Ligand-Target Pair
Prostanoid IP receptor


(Homo sapiens (Human))
BDBM50101818
PNG
((Z)-7-{(1R,2S,3R)-2-[(E)-(S)-4-(1-Ethyl-cyclobutyl...)
Show SMILES CCC1(CCC1)[C@@H](O)C\C=C\[C@H]1[C@H](O)CC[C@@H]1C\C=C/CCCC(O)=O
Show InChI InChI=1S/C22H36O4/c1-2-22(15-8-16-22)20(24)11-7-10-18-17(13-14-19(18)23)9-5-3-4-6-12-21(25)26/h3,5,7,10,17-20,23-24H,2,4,6,8-9,11-16H2,1H3,(H,25,26)/b5-3-,10-7+/t17-,18+,19+,20-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human Prostanoid IP receptor in CHO cells.


Bioorg Med Chem Lett 11: 2025-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CV4H1T
More data for this
Ligand-Target Pair
Prostanoid EP3 Receptor


(Mus musculus (Mouse))
BDBM50101818
PNG
((Z)-7-{(1R,2S,3R)-2-[(E)-(S)-4-(1-Ethyl-cyclobutyl...)
Show SMILES CCC1(CCC1)[C@@H](O)C\C=C\[C@H]1[C@H](O)CC[C@@H]1C\C=C/CCCC(O)=O
Show InChI InChI=1S/C22H36O4/c1-2-22(15-8-16-22)20(24)11-7-10-18-17(13-14-19(18)23)9-5-3-4-6-12-21(25)26/h3,5,7,10,17-20,23-24H,2,4,6,8-9,11-16H2,1H3,(H,25,26)/b5-3-,10-7+/t17-,18+,19+,20-/m0/s1
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PC cid
PC sid
UniChem

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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards mouse Prostanoid EP3 receptor in CHO cells.


Bioorg Med Chem Lett 11: 2025-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CV4H1T
More data for this
Ligand-Target Pair
Prostanoid EP2 receptor


(Mus musculus (Mouse))
BDBM50101818
PNG
((Z)-7-{(1R,2S,3R)-2-[(E)-(S)-4-(1-Ethyl-cyclobutyl...)
Show SMILES CCC1(CCC1)[C@@H](O)C\C=C\[C@H]1[C@H](O)CC[C@@H]1C\C=C/CCCC(O)=O
Show InChI InChI=1S/C22H36O4/c1-2-22(15-8-16-22)20(24)11-7-10-18-17(13-14-19(18)23)9-5-3-4-6-12-21(25)26/h3,5,7,10,17-20,23-24H,2,4,6,8-9,11-16H2,1H3,(H,25,26)/b5-3-,10-7+/t17-,18+,19+,20-/m0/s1
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n/an/an/an/a 1.40E+3n/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Effective concentration which increases intracellular c-AMP production in mouse Prostanoid EP2 receptor


Bioorg Med Chem Lett 11: 2025-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CV4H1T
More data for this
Ligand-Target Pair