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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostacyclin receptor' and Ligand = 'BDBM50223867'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Prostacyclin receptor


(Homo sapiens (Human))
BDBM50223867
PNG
(CHEMBL9999)
Show SMILES COc1ccc(Sc2ccc(CC3=NCCN3)cc2)cc1 |t:12|
Show InChI InChI=1S/C17H18N2OS/c1-20-14-4-8-16(9-5-14)21-15-6-2-13(3-7-15)12-17-18-10-11-19-17/h2-9H,10-12H2,1H3,(H,18,19)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
5.01E+3n/an/an/an/an/an/an/an/a



Roche Palo Alto

Curated by ChEMBL


Assay Description
Binding affinity towards prostacyclin receptor on rat NG-108-15 neuroblastoma cells, using [3H]iloprost as a radioligand


Bioorg Med Chem Lett 14: 1053-6 (2004)


BindingDB Entry DOI: 10.7270/Q2M90BVN
More data for this
Ligand-Target Pair