BindingDB PrimarySearch_ki

Search and Browse
- Target
- Compound
- Special tools
- Citation
- Special Data Sets
- Other Databases
  - PDB 85% 100% Seq ID
  - UniProtKB/Swiss-Prot
  - UniProtKB/TrEMBL
  - PubMed
Download
- All Compounds & Data
- Target Names &
  - Ki IC50 Kd EC50
  - ΔG° ΔH° -TΔS°
Enter Data

BDBM50198833 (R)-2-amino-3-(3-octylphenylamino)-3-oxopropyl dihydrogen phosphate::CHEMBL228102

SMILES: CCCCCCCCc1cccc(NC(=O)[C@H](N)COP(O)(O)=O)c1

InChI Key: InChIKey=MRUSUGVVWGNKFE-UHFFFAOYSA-N

Data: 4 EC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50198833
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Sphingosine 1-phosphate receptor 4 (Human)	BDBM50198833 ((R)-2-amino-3-(3-octylphenylamino)-3-oxopropyl dih...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	500	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 3 (Human)	BDBM50198833 ((R)-2-amino-3-(3-octylphenylamino)-3-oxopropyl dih...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	450	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 1 (Human)	BDBM50198833 ((R)-2-amino-3-(3-octylphenylamino)-3-oxopropyl dih...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	58	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 5 (Human)	BDBM50198833 ((R)-2-amino-3-(3-octylphenylamino)-3-oxopropyl dih...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	52	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair