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BDBM50065619 CHEMBL3401374

SMILES: CCC(CC)CC1(O)CCN(CC1)C(=O)Nc1ccc(C)c(Oc2ccccc2)c1

InChI Key: InChIKey=ZOZWIRWQSWWBBT-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50065619   
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
Sphingosine 1-Phosphate Receptor 2


(Homo sapiens (Human))
BDBM50065619
PNG
(CHEMBL3401374)
Show SMILES CCC(CC)CC1(O)CCN(CC1)C(=O)Nc1ccc(C)c(Oc2ccccc2)c1
Show InChI InChI=1S/C25H34N2O3/c1-4-20(5-2)18-25(29)13-15-27(16-14-25)24(28)26-21-12-11-19(3)23(17-21)30-22-9-7-6-8-10-22/h6-12,17,20,29H,4-5,13-16,18H2,1-3H3,(H,26,28)
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



Ono Pharmaceutical Co.

Curated by ChEMBL


Assay Description
Antagonist activity at human S1P2 receptor overexpressed in CHO cells assessed as increase in intracellular calcium ion concentration incubated 3 min...


Bioorg Med Chem Lett 25: 1479-82 (2015)


Article DOI: 10.1016/j.bmcl.2015.02.029
BindingDB Entry DOI: 10.7270/Q2D79D3G
More data for this
Ligand-Target Pair