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BDBM50152514 CHEMBL365829::{1-[4-(Chroman-2-ylmethoxy)-benzoyl]-2-methyl-1H-indol-4-yl}-acetic acid

SMILES: Cc1cc2c(CC(O)=O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1

InChI Key: InChIKey=GWYIZWZVKYKMGF-UHFFFAOYSA-N

Data: 6 KI  1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50152514   
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 DP receptor


(Homo sapiens (Human))
BDBM50152514
PNG
(CHEMBL365829 | {1-[4-(Chroman-2-ylmethoxy)-benzoyl...)
Show SMILES Cc1cc2c(CC(O)=O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1
Show InChI InChI=1S/C28H25NO5/c1-18-15-24-21(16-27(30)31)6-4-7-25(24)29(18)28(32)20-10-12-22(13-11-20)33-17-23-14-9-19-5-2-3-8-26(19)34-23/h2-8,10-13,15,23H,9,14,16-17H2,1H3,(H,30,31)
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50n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Ability to inhibit the binding of [3H]-PGD-2 radioligand to membranes of CHO cells stably expressing human Prostaglandin D2 receptor


Bioorg Med Chem Lett 14: 4891-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.039
BindingDB Entry DOI: 10.7270/Q2BK1BTV
More data for this
Ligand-Target Pair
Prostanoid DP receptor


(Mus musculus)
BDBM50152514
PNG
(CHEMBL365829 | {1-[4-(Chroman-2-ylmethoxy)-benzoyl...)
Show SMILES Cc1cc2c(CC(O)=O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1
Show InChI InChI=1S/C28H25NO5/c1-18-15-24-21(16-27(30)31)6-4-7-25(24)29(18)28(32)20-10-12-22(13-11-20)33-17-23-14-9-19-5-2-3-8-26(19)34-23/h2-8,10-13,15,23H,9,14,16-17H2,1H3,(H,30,31)
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60n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Ability to inhibit the binding of [3H]-PGD-2 radioligand to membranes of CHO cells stably expressing mouse Prostaglandin D2 receptor


Bioorg Med Chem Lett 14: 4891-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.039
BindingDB Entry DOI: 10.7270/Q2BK1BTV
More data for this
Ligand-Target Pair
Prostanoid EP2 Receptor


(Mus musculus (Mouse))
BDBM50152514
PNG
(CHEMBL365829 | {1-[4-(Chroman-2-ylmethoxy)-benzoyl...)
Show SMILES Cc1cc2c(CC(O)=O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1
Show InChI InChI=1S/C28H25NO5/c1-18-15-24-21(16-27(30)31)6-4-7-25(24)29(18)28(32)20-10-12-22(13-11-20)33-17-23-14-9-19-5-2-3-8-26(19)34-23/h2-8,10-13,15,23H,9,14,16-17H2,1H3,(H,30,31)
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90n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Ability to inhibit the binding of [3H]-PGD-2 radioligand to membranes of CHO cells stably expressing mouse Prostaglandin E receptor EP2


Bioorg Med Chem Lett 14: 4891-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.039
BindingDB Entry DOI: 10.7270/Q2BK1BTV
More data for this
Ligand-Target Pair
Prostanoid EP4 Receptor


(Mus musculus (Mouse))
BDBM50152514
PNG
(CHEMBL365829 | {1-[4-(Chroman-2-ylmethoxy)-benzoyl...)
Show SMILES Cc1cc2c(CC(O)=O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1
Show InChI InChI=1S/C28H25NO5/c1-18-15-24-21(16-27(30)31)6-4-7-25(24)29(18)28(32)20-10-12-22(13-11-20)33-17-23-14-9-19-5-2-3-8-26(19)34-23/h2-8,10-13,15,23H,9,14,16-17H2,1H3,(H,30,31)
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3.10E+3n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Ability to inhibit the binding of [3H]-PGD-2 radioligand to membranes of CHO cells stably expressing mouse Prostaglandin E receptor EP4


Bioorg Med Chem Lett 14: 4891-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.039
BindingDB Entry DOI: 10.7270/Q2BK1BTV
More data for this
Ligand-Target Pair
Prostanoid EP1 Receptor


(Mus musculus (Mouse))
BDBM50152514
PNG
(CHEMBL365829 | {1-[4-(Chroman-2-ylmethoxy)-benzoyl...)
Show SMILES Cc1cc2c(CC(O)=O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1
Show InChI InChI=1S/C28H25NO5/c1-18-15-24-21(16-27(30)31)6-4-7-25(24)29(18)28(32)20-10-12-22(13-11-20)33-17-23-14-9-19-5-2-3-8-26(19)34-23/h2-8,10-13,15,23H,9,14,16-17H2,1H3,(H,30,31)
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3.80E+3n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Ability to inhibit the binding of [3H]-PGD-2 radioligand to membranes of CHO cells stably expressing mouse Prostaglandin E receptor EP1


Bioorg Med Chem Lett 14: 4891-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.039
BindingDB Entry DOI: 10.7270/Q2BK1BTV
More data for this
Ligand-Target Pair
Prostanoid EP3 Receptor


(Mus musculus (Mouse))
BDBM50152514
PNG
(CHEMBL365829 | {1-[4-(Chroman-2-ylmethoxy)-benzoyl...)
Show SMILES Cc1cc2c(CC(O)=O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1
Show InChI InChI=1S/C28H25NO5/c1-18-15-24-21(16-27(30)31)6-4-7-25(24)29(18)28(32)20-10-12-22(13-11-20)33-17-23-14-9-19-5-2-3-8-26(19)34-23/h2-8,10-13,15,23H,9,14,16-17H2,1H3,(H,30,31)
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>1.00E+4n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Ability to inhibit the binding of [3H]-PGD-2 radioligand to membranes of CHO cells stably expressing mouse Prostaglandin E receptor EP3


Bioorg Med Chem Lett 14: 4891-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.039
BindingDB Entry DOI: 10.7270/Q2BK1BTV
More data for this
Ligand-Target Pair
Prostanoid DP receptor


(Homo sapiens (Human))
BDBM50152514
PNG
(CHEMBL365829 | {1-[4-(Chroman-2-ylmethoxy)-benzoyl...)
Show SMILES Cc1cc2c(CC(O)=O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1
Show InChI InChI=1S/C28H25NO5/c1-18-15-24-21(16-27(30)31)6-4-7-25(24)29(18)28(32)20-10-12-22(13-11-20)33-17-23-14-9-19-5-2-3-8-26(19)34-23/h2-8,10-13,15,23H,9,14,16-17H2,1H3,(H,30,31)
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n/an/a 30n/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Effect on the increase in cAMP formation induced by PGD-2 in the presence of bovine serum albumin in CHO cells expressing human Prostaglandin D2 rece...


Bioorg Med Chem Lett 14: 4891-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.039
BindingDB Entry DOI: 10.7270/Q2BK1BTV
More data for this
Ligand-Target Pair