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SMILES: Cc1cc(F)ccc1-c1cccc(c1)C(O)\C=C\[C@H]1CCC(=O)N1CCCc1ccc(cc1)C(O)=O

InChI Key: InChIKey=VHROTHARGKCIBF-AUNKXPJZSA-N

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 = 202310   
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 EP4 subtype


(Homo sapiens (Human))
BDBM202310
PNG
(US9540357, example 11 | US9540357, example 12)
Show SMILES Cc1cc(F)ccc1-c1cccc(c1)C(O)\C=C\[C@H]1CCC(=O)N1CCCc1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C30H30FNO4/c1-20-18-25(31)11-14-27(20)23-5-2-6-24(19-23)28(33)15-12-26-13-16-29(34)32(26)17-3-4-21-7-9-22(10-8-21)30(35)36/h2,5-12,14-15,18-19,26,28,33H,3-4,13,16-17H2,1H3,(H,35,36)/b15-12+/t26-,28?/m0/s1
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US Patent
53 -9.92n/an/an/an/an/a7.425



Allergan, Inc.

US Patent


Assay Description
A 384-well drug plate was prepared to contain 6 test compounds, PGE2 and cAMP in 16 serial dilutions in triplicate, using a Biomek station. HEK-EBNA ...


US Patent US9540357 (2017)


BindingDB Entry DOI: 10.7270/Q24M92QQ
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM202310
PNG
(US9540357, example 11 | US9540357, example 12)
Show SMILES Cc1cc(F)ccc1-c1cccc(c1)C(O)\C=C\[C@H]1CCC(=O)N1CCCc1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C30H30FNO4/c1-20-18-25(31)11-14-27(20)23-5-2-6-24(19-23)28(33)15-12-26-13-16-29(34)32(26)17-3-4-21-7-9-22(10-8-21)30(35)36/h2,5-12,14-15,18-19,26,28,33H,3-4,13,16-17H2,1H3,(H,35,36)/b15-12+/t26-,28?/m0/s1
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PC sid
UniChem
US Patent
>1.34E+3>-8.01n/an/an/an/an/a7.425



Allergan, Inc.

US Patent


Assay Description
A 384-well drug plate was prepared to contain 6 test compounds, PGE2 and cAMP in 16 serial dilutions in triplicate, using a Biomek station. HEK-EBNA ...


US Patent US9540357 (2017)


BindingDB Entry DOI: 10.7270/Q24M92QQ
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM202310
PNG
(US9540357, example 11 | US9540357, example 12)
Show SMILES Cc1cc(F)ccc1-c1cccc(c1)C(O)\C=C\[C@H]1CCC(=O)N1CCCc1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C30H30FNO4/c1-20-18-25(31)11-14-27(20)23-5-2-6-24(19-23)28(33)15-12-26-13-16-29(34)32(26)17-3-4-21-7-9-22(10-8-21)30(35)36/h2,5-12,14-15,18-19,26,28,33H,3-4,13,16-17H2,1H3,(H,35,36)/b15-12+/t26-,28?/m0/s1
PDB

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UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem
US Patent
>1.00E+4>-6.82n/an/an/an/an/a7.425



Allergan, Inc.

US Patent


Assay Description
A 384-well drug plate was prepared to contain 6 test compounds, PGE2 and cAMP in 16 serial dilutions in triplicate, using a Biomek station. HEK-EBNA ...


US Patent US9540357 (2017)


BindingDB Entry DOI: 10.7270/Q24M92QQ
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM202310
PNG
(US9540357, example 11 | US9540357, example 12)
Show SMILES Cc1cc(F)ccc1-c1cccc(c1)C(O)\C=C\[C@H]1CCC(=O)N1CCCc1ccc(cc1)C(O)=O |r|
Show InChI InChI=1S/C30H30FNO4/c1-20-18-25(31)11-14-27(20)23-5-2-6-24(19-23)28(33)15-12-26-13-16-29(34)32(26)17-3-4-21-7-9-22(10-8-21)30(35)36/h2,5-12,14-15,18-19,26,28,33H,3-4,13,16-17H2,1H3,(H,35,36)/b15-12+/t26-,28?/m0/s1
PDB

Reactome pathway
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UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
>1.00E+4>-6.82n/an/an/an/an/a7.425



Allergan, Inc.

US Patent


Assay Description
A 384-well drug plate was prepared to contain 6 test compounds, PGE2 and cAMP in 16 serial dilutions in triplicate, using a Biomek station. HEK-EBNA ...


US Patent US9540357 (2017)


BindingDB Entry DOI: 10.7270/Q24M92QQ
More data for this
Ligand-Target Pair