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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sphingosine 1-phosphate receptor 5' and Ligand = 'BDBM50559608'   
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
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50559608
PNG
(CHEMBL4787014)
Show SMILES Cc1cc(O[C@H]2CC[C@H](CC2)c2ccccc2)c(CN2CCC(CC2)C(O)=O)c2ccccc12 |r,wU:5.4,8.11,(20.79,-5.32,;20.79,-6.86,;19.46,-7.63,;19.46,-9.17,;18.13,-9.94,;16.8,-9.17,;15.47,-9.94,;14.13,-9.16,;14.14,-7.62,;15.48,-6.85,;16.8,-7.62,;12.81,-6.84,;12.82,-5.3,;11.49,-4.52,;10.15,-5.29,;10.15,-6.84,;11.48,-7.61,;20.8,-9.94,;20.8,-11.48,;22.14,-12.25,;22.13,-13.79,;23.46,-14.56,;24.8,-13.79,;24.8,-12.25,;23.46,-11.47,;26.13,-14.56,;27.47,-13.8,;26.13,-16.1,;22.13,-9.17,;23.47,-9.93,;24.8,-9.16,;24.79,-7.61,;23.45,-6.85,;22.13,-7.62,)|
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 1.54E+3n/an/an/an/a


TBA

Assay Description
Antagonist activity at recombinant human S1P5 receptor expressed in Chem-1 cells assessed as EC80 S1P-induced calcium flux measured for 180 secs by F...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.0c00631
BindingDB Entry DOI: 10.7270/Q2D79G4R
More data for this
Ligand-Target Pair