BDBM50152332 CHEMBL185066::[3-(2-Tetradecyl-pyrrolidin-1-yl)-propyl]-phosphonic acid

SMILES: CCCCCCCCCCCCCCC1CCCN1CCCP(O)(O)=O

InChI Key: InChIKey=KZVBKYTVBGVQAA-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50152332   

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 4 (Homo sapiens (Human))	BDBM50152332 (CHEMBL185066 | [3-(2-Tetradecyl-pyrrolidin-1-yl)-p...) Show SMILES CCCCCCCCCCCCCCC1CCCN1CCCP(O)(O)=O Show InChI InChI=1S/C21H44NO3P/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21-17-14-18-22(21)19-15-20-26(23,24)25/h21H,2-20H2,1H3,(H2,23,24,25)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [33P]-S1P binding to human Sphingosine 1-phosphate receptor 4 expressed on CHO cell membranes				Bioorg Med Chem Lett 14: 4861-6 (2004) Article DOI: 10.1016/j.bmcl.2004.07.049 BindingDB Entry DOI: 10.7270/Q2BK1D38
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human))	BDBM50152332 (CHEMBL185066 | [3-(2-Tetradecyl-pyrrolidin-1-yl)-p...) Show SMILES CCCCCCCCCCCCCCC1CCCN1CCCP(O)(O)=O Show InChI InChI=1S/C21H44NO3P/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21-17-14-18-22(21)19-15-20-26(23,24)25/h21H,2-20H2,1H3,(H2,23,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [33P]-S1P binding to human Sphingosine 1-phosphate receptor 1 expressed on CHO cell membranes				Bioorg Med Chem Lett 14: 4861-6 (2004) Article DOI: 10.1016/j.bmcl.2004.07.049 BindingDB Entry DOI: 10.7270/Q2BK1D38
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 2 (Homo sapiens (Human))	BDBM50152332 (CHEMBL185066 | [3-(2-Tetradecyl-pyrrolidin-1-yl)-p...) Show SMILES CCCCCCCCCCCCCCC1CCCN1CCCP(O)(O)=O Show InChI InChI=1S/C21H44NO3P/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21-17-14-18-22(21)19-15-20-26(23,24)25/h21H,2-20H2,1H3,(H2,23,24,25)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [33P]-S1P binding to human Sphingosine 1-phosphate receptor 2 expressed on CHO cell membranes				Bioorg Med Chem Lett 14: 4861-6 (2004) Article DOI: 10.1016/j.bmcl.2004.07.049 BindingDB Entry DOI: 10.7270/Q2BK1D38
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 5 (Homo sapiens (Human))	BDBM50152332 (CHEMBL185066 | [3-(2-Tetradecyl-pyrrolidin-1-yl)-p...) Show SMILES CCCCCCCCCCCCCCC1CCCN1CCCP(O)(O)=O Show InChI InChI=1S/C21H44NO3P/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21-17-14-18-22(21)19-15-20-26(23,24)25/h21H,2-20H2,1H3,(H2,23,24,25)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	680	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [33P]-S1P binding to human Sphingosine 1-phosphate receptor 5 expressed on CHO cell membranes				Bioorg Med Chem Lett 14: 4861-6 (2004) Article DOI: 10.1016/j.bmcl.2004.07.049 BindingDB Entry DOI: 10.7270/Q2BK1D38
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 3 (Homo sapiens (Human))	BDBM50152332 (CHEMBL185066 | [3-(2-Tetradecyl-pyrrolidin-1-yl)-p...) Show SMILES CCCCCCCCCCCCCCC1CCCN1CCCP(O)(O)=O Show InChI InChI=1S/C21H44NO3P/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21-17-14-18-22(21)19-15-20-26(23,24)25/h21H,2-20H2,1H3,(H2,23,24,25)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [33P]-S1P binding to human Sphingosine 1-phosphate receptor 3 expressed on CHO cell membranes				Bioorg Med Chem Lett 14: 4861-6 (2004) Article DOI: 10.1016/j.bmcl.2004.07.049 BindingDB Entry DOI: 10.7270/Q2BK1D38
					More data for this Ligand-Target Pair