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SMILES: COc1ccccc1Sc1ccc(NC2=NCCN2)cc1

InChI Key: InChIKey=GGFYZXJLWFDDFX-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50223857   
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
Prostacyclin receptor


(Homo sapiens (Human))		BDBM50223857
PNG
(CHEMBL9442)
Show SMILES COc1ccccc1Sc1ccc(NC2=NCCN2)cc1 |t:15|
Show InChI InChI=1S/C16H17N3OS/c1-20-14-4-2-3-5-15(14)21-13-8-6-12(7-9-13)19-16-17-10-11-18-16/h2-9H,10-11H2,1H3,(H2,17,18,19)
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 3.98E+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