BindingDB logo
myBDB logout

BDBM50499635 CHEMBL3739695

SMILES: OC(=O)C1CN(Cc2ccc(OCc3ccc(F)cc3)cc2)C1

InChI Key: InChIKey=OFPIQTMYKZMOME-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50499635   
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 5


(Homo sapiens (Human))
BDBM50499635
PNG
(CHEMBL3739695)
Show SMILES OC(=O)C1CN(Cc2ccc(OCc3ccc(F)cc3)cc2)C1
Show InChI InChI=1S/C18H18FNO3/c19-16-5-1-14(2-6-16)12-23-17-7-3-13(4-8-17)9-20-10-15(11-20)18(21)22/h1-8,15H,9-12H2,(H,21,22)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9n/an/an/an/an/an/a



AbbVie Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [33P]S1P from S1P5 receptor (unknown origin) expressed in HEK cell membranes after 45 to 60 mins by scintillation counting based RLB ...


J Med Chem 58: 9154-70 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00928
BindingDB Entry DOI: 10.7270/Q2PZ5CV4
More data for this
Ligand-Target Pair