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BDBM50160918 CHEMBL182662::N-{3-[3-(2-Benzyloxy-5-chloro-phenyl)-thiophen-2-yl]-phenyl}-C-phenyl-methanesulfonamide

SMILES: Clc1ccc(OCc2ccccc2)c(c1)-c1ccsc1-c1cccc(NS(=O)(=O)Cc2ccccc2)c1

InChI Key: InChIKey=DOFJFNAZXDVIHD-UHFFFAOYSA-N

Data: 3 KI

Find this compound or compounds like it in BindingDB or PDB:
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50160918   
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 EP1 subtype (EP1)


(Homo sapiens (Human))
BDBM50160918
PNG
(CHEMBL182662 | N-{3-[3-(2-Benzyloxy-5-chloro-pheny...)
Show SMILES Clc1ccc(OCc2ccccc2)c(c1)-c1ccsc1-c1cccc(NS(=O)(=O)Cc2ccccc2)c1
Show InChI InChI=1S/C30H24ClNO3S2/c31-25-14-15-29(35-20-22-8-3-1-4-9-22)28(19-25)27-16-17-36-30(27)24-12-7-13-26(18-24)32-37(33,34)21-23-10-5-2-6-11-23/h1-19,32H,20-21H2
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
52n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Binding affinity against Prostaglandin E receptor was determined in human


Bioorg Med Chem Lett 15: 1155-60 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.005
BindingDB Entry DOI: 10.7270/Q2SF2VNV
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP1 subtype (EP1)


(Homo sapiens (Human))
BDBM50160918
PNG
(CHEMBL182662 | N-{3-[3-(2-Benzyloxy-5-chloro-pheny...)
Show SMILES Clc1ccc(OCc2ccccc2)c(c1)-c1ccsc1-c1cccc(NS(=O)(=O)Cc2ccccc2)c1
Show InChI InChI=1S/C30H24ClNO3S2/c31-25-14-15-29(35-20-22-8-3-1-4-9-22)28(19-25)27-16-17-36-30(27)24-12-7-13-26(18-24)32-37(33,34)21-23-10-5-2-6-11-23/h1-19,32H,20-21H2
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
72n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Binding affinity against Prostaglandin E receptor in presence of 2% human serum albumin


Bioorg Med Chem Lett 15: 1155-60 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.005
BindingDB Entry DOI: 10.7270/Q2SF2VNV
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50160918
PNG
(CHEMBL182662 | N-{3-[3-(2-Benzyloxy-5-chloro-pheny...)
Show SMILES Clc1ccc(OCc2ccccc2)c(c1)-c1ccsc1-c1cccc(NS(=O)(=O)Cc2ccccc2)c1
Show InChI InChI=1S/C30H24ClNO3S2/c31-25-14-15-29(35-20-22-8-3-1-4-9-22)28(19-25)27-16-17-36-30(27)24-12-7-13-26(18-24)32-37(33,34)21-23-10-5-2-6-11-23/h1-19,32H,20-21H2
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>2.10E+4n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Binding affinity against human Prostanoid TP receptor


Bioorg Med Chem Lett 15: 1155-60 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.005
BindingDB Entry DOI: 10.7270/Q2SF2VNV
More data for this
Ligand-Target Pair