BDBM50133424 CHEMBL116953::Phosphoric acid mono-[(R)-2-amino-2-(4-dodecyl-phenylcarbamoyl)-ethyl] ester; TFA

SMILES: CCCCCCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1

InChI Key: InChIKey=LEXPXIZYFRSZSD-HXUWFJFHSA-N

Data: 4 EC50

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 4 hits for monomerid = 50133424   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Sphingosine 1-phosphate receptor 5 (Homo sapiens (Human))	BDBM50133424 (CHEMBL116953 | Phosphoric acid mono-[(R)-2-amino-2...) Show SMILES CCCCCCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1 Show InChI InChI=1S/C21H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)23-21(24)20(22)17-28-29(25,26)27/h13-16,20H,2-12,17,22H2,1H3,(H,23,24)(H2,25,26,27)/t20-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	160	n/a	n/a	n/a	n/a
University of Virginia Curated by ChEMBL					Assay Description In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand				Bioorg Med Chem Lett 13: 3401-4 (2003) BindingDB Entry DOI: 10.7270/Q29S1RMW
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 3 (Homo sapiens (Human))	BDBM50133424 (CHEMBL116953 | Phosphoric acid mono-[(R)-2-amino-2...) Show SMILES CCCCCCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1 Show InChI InChI=1S/C21H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)23-21(24)20(22)17-28-29(25,26)27/h13-16,20H,2-12,17,22H2,1H3,(H,23,24)(H2,25,26,27)/t20-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	740	n/a	n/a	n/a	n/a
University of Virginia Curated by ChEMBL					Assay Description In vitro binding affinity towards human Sphingosine 1-phosphate receptor 3 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand				Bioorg Med Chem Lett 13: 3401-4 (2003) BindingDB Entry DOI: 10.7270/Q29S1RMW
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human))	BDBM50133424 (CHEMBL116953 | Phosphoric acid mono-[(R)-2-amino-2...) Show SMILES CCCCCCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1 Show InChI InChI=1S/C21H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)23-21(24)20(22)17-28-29(25,26)27/h13-16,20H,2-12,17,22H2,1H3,(H,23,24)(H2,25,26,27)/t20-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	130	n/a	n/a	n/a	n/a
University of Virginia Curated by ChEMBL					Assay Description In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand				Bioorg Med Chem Lett 13: 3401-4 (2003) BindingDB Entry DOI: 10.7270/Q29S1RMW
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 4 (Homo sapiens (Human))	BDBM50133424 (CHEMBL116953 | Phosphoric acid mono-[(R)-2-amino-2...) Show SMILES CCCCCCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1 Show InChI InChI=1S/C21H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)23-21(24)20(22)17-28-29(25,26)27/h13-16,20H,2-12,17,22H2,1H3,(H,23,24)(H2,25,26,27)/t20-/m1/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a
University of Virginia Curated by ChEMBL					Assay Description In vitro binding affinity towards human Sphingosine 1-phosphate receptor 4 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand				Bioorg Med Chem Lett 13: 3401-4 (2003) BindingDB Entry DOI: 10.7270/Q29S1RMW
					More data for this Ligand-Target Pair