BDBM50380411 CHEMBL2018465

SMILES Clc1ccc(Oc2ccc(NC(=O)[C@H](COCc3ccccc3)NC(=O)Cc3cnc[nH]3)cc2)cc1

InChI Key InChIKey=MWFYBAMREXCQRG-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50380411   

TargetSphingosine 1-phosphate receptor 1(Human)
Exelixis

Curated by ChEMBL
LigandPNGBDBM50380411(CHEMBL2018465)
Affinity DataIC50: 32nMAssay Description:Antagonist activity at S1P1 receptor expressed in HEK293 cells assessed as inhibition of S1P-induced cAMP response after 90 mins by spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2013
Entry Details Article
PubMed
TargetSphingosine 1-phosphate receptor 1(Human)
Exelixis

Curated by ChEMBL
LigandPNGBDBM50380411(CHEMBL2018465)
Affinity DataIC50: 221nMAssay Description:Antagonist activity at S1P1 receptor expressed in HEK293 cells assessed as inhibition of S1P-induced tango beta-arrestin recruitment preincubated for...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2013
Entry Details Article
PubMed
TargetSphingosine 1-phosphate receptor 3(Human)
Exelixis

Curated by ChEMBL
LigandPNGBDBM50380411(CHEMBL2018465)
Affinity DataIC50: 1.00E+4nMAssay Description:Antagonist activity at S1P3 receptor expressed in HEK293 cells assessed as inhibition of S1P-induced tango beta-arrestin recruitment preincubated for...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2013
Entry Details Article
PubMed
TargetSphingosine 1-phosphate receptor 2(Human)
Exelixis

Curated by ChEMBL
LigandPNGBDBM50380411(CHEMBL2018465)
Affinity DataIC50: 1.00E+4nMAssay Description:Antagonist activity at S1P2 receptor expressed in HEK293 cells assessed as inhibition of S1P-induced tango beta-arrestin recruitment preincubated for...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2013
Entry Details Article
PubMed