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BDBM50171473 CHEMBL187758::[3-(3-Benzhydrylsulfanyl-propyl)-benzofuran-7-yloxy]-acetic acid

SMILES: OC(=O)COc1cccc2c(CCCSC(c3ccccc3)c3ccccc3)coc12

InChI Key: InChIKey=VGCNWPGNHRONEY-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50171473   
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 IP receptor


(Homo sapiens (Human))
BDBM50171473
PNG
(CHEMBL187758 | [3-(3-Benzhydrylsulfanyl-propyl)-be...)
Show SMILES OC(=O)COc1cccc2c(CCCSC(c3ccccc3)c3ccccc3)coc12
Show InChI InChI=1S/C26H24O4S/c27-24(28)18-29-23-15-7-14-22-21(17-30-25(22)23)13-8-16-31-26(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-7,9-12,14-15,17,26H,8,13,16,18H2,(H,27,28)
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
270n/an/an/an/an/an/an/an/a



Toray Industries Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]-APS-314d binding to prostacyclin receptors (IP) of human platelet membrane


J Med Chem 48: 5279-94 (2005)


Article DOI: 10.1021/jm050194z
BindingDB Entry DOI: 10.7270/Q2J67GGC
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50171473
PNG
(CHEMBL187758 | [3-(3-Benzhydrylsulfanyl-propyl)-be...)
Show SMILES OC(=O)COc1cccc2c(CCCSC(c3ccccc3)c3ccccc3)coc12
Show InChI InChI=1S/C26H24O4S/c27-24(28)18-29-23-15-7-14-22-21(17-30-25(22)23)13-8-16-31-26(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-7,9-12,14-15,17,26H,8,13,16,18H2,(H,27,28)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
3.10E+3n/an/an/an/an/an/an/an/a



Toray Industries Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SQ-29,548 binding to thromboxane A2 receptors (TP) of human platelet membrane


J Med Chem 48: 5279-94 (2005)


Article DOI: 10.1021/jm050194z
BindingDB Entry DOI: 10.7270/Q2J67GGC
More data for this
Ligand-Target Pair