BindingDB logo
myBDB logout

BDBM50333864 (R)-2-(7-(4-methoxy-N-methylphenylsulfonamido)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl)acetic acid::CHEMBL1643798

SMILES: COc1ccc(cc1)S(=O)(=O)N(C)[C@@H]1CCc2c(CC(O)=O)c3ccccc3n2C1

InChI Key: InChIKey=FABSXONIHXZYLC-OAHLLOKOSA-N

Data: 3 KI  1 IC50

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 = 50333864   
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
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM50333864
PNG
((R)-2-(7-(4-methoxy-N-methylphenylsulfonamido)-6,7...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N(C)[C@@H]1CCc2c(CC(O)=O)c3ccccc3n2C1 |r|
Show InChI InChI=1S/C22H24N2O5S/c1-23(30(27,28)17-10-8-16(29-2)9-11-17)15-7-12-21-19(13-22(25)26)18-5-3-4-6-20(18)24(21)14-15/h3-6,8-11,15H,7,12-14H2,1-2H3,(H,25,26)/t15-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.40n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant CRTH2 receptor by cell based radioligand equilibrium competition assay


Bioorg Med Chem Lett 21: 288-93 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.015
BindingDB Entry DOI: 10.7270/Q2959HTH
More data for this
Ligand-Target Pair
Prostanoid DP receptor


(Homo sapiens (Human))
BDBM50333864
PNG
((R)-2-(7-(4-methoxy-N-methylphenylsulfonamido)-6,7...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N(C)[C@@H]1CCc2c(CC(O)=O)c3ccccc3n2C1 |r|
Show InChI InChI=1S/C22H24N2O5S/c1-23(30(27,28)17-10-8-16(29-2)9-11-17)15-7-12-21-19(13-22(25)26)18-5-3-4-6-20(18)24(21)14-15/h3-6,8-11,15H,7,12-14H2,1-2H3,(H,25,26)/t15-/m1/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
26n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Binding affinity to prostanoid DP1 receptor


Bioorg Med Chem Lett 21: 288-93 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.015
BindingDB Entry DOI: 10.7270/Q2959HTH
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50333864
PNG
((R)-2-(7-(4-methoxy-N-methylphenylsulfonamido)-6,7...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N(C)[C@@H]1CCc2c(CC(O)=O)c3ccccc3n2C1 |r|
Show InChI InChI=1S/C22H24N2O5S/c1-23(30(27,28)17-10-8-16(29-2)9-11-17)15-7-12-21-19(13-22(25)26)18-5-3-4-6-20(18)24(21)14-15/h3-6,8-11,15H,7,12-14H2,1-2H3,(H,25,26)/t15-/m1/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>7.10E+3n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Binding affinity to thromboxane receptor


Bioorg Med Chem Lett 21: 288-93 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.015
BindingDB Entry DOI: 10.7270/Q2959HTH
More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM50333864
PNG
((R)-2-(7-(4-methoxy-N-methylphenylsulfonamido)-6,7...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N(C)[C@@H]1CCc2c(CC(O)=O)c3ccccc3n2C1 |r|
Show InChI InChI=1S/C22H24N2O5S/c1-23(30(27,28)17-10-8-16(29-2)9-11-17)15-7-12-21-19(13-22(25)26)18-5-3-4-6-20(18)24(21)14-15/h3-6,8-11,15H,7,12-14H2,1-2H3,(H,25,26)/t15-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.5n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant CRTH2 receptor expressed in HEK293 cells assessed as inhibition of DK-PGD2-induced intracellular cAMP format...


Bioorg Med Chem Lett 21: 288-93 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.015
BindingDB Entry DOI: 10.7270/Q2959HTH
More data for this
Ligand-Target Pair