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BDBM50163051 CHEMBL3793336

SMILES: OC(=O)COc1ccc(CCN(C(=O)c2ccccc2)c2ccc(Cl)cc2)cc1

InChI Key: InChIKey=RXWMWVXXTSPHTJ-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 50163051   
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))
BDBM50163051
PNG
(CHEMBL3793336)
Show SMILES OC(=O)COc1ccc(CCN(C(=O)c2ccccc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C23H20ClNO4/c24-19-8-10-20(11-9-19)25(23(28)18-4-2-1-3-5-18)15-14-17-6-12-21(13-7-17)29-16-22(26)27/h1-13H,14-16H2,(H,26,27)
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 740n/an/an/an/an/an/a



Toray Industries Inc

Curated by ChEMBL


Assay Description
Agonist activity at human IP receptor in platelet rich plasma assessed as inhibition of ADP-induced platelet aggregation preincubated for 1 min follo...


Bioorg Med Chem Lett 26: 2360-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.009
BindingDB Entry DOI: 10.7270/Q2Q52RJW
More data for this
Ligand-Target Pair