Compile Data Set for Download or QSAR

Found 5 hits of ic50 for monomerid = 50148428   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Sphingosine 1-phosphate receptor 2 (Homo sapiens (Human))	BDBM50148428 (CHEMBL325247 | [3-(3-Bromo-4-hexyloxy-5-methoxy-be...) Show SMILES CCCCCCOc1c(Br)cc(CNCCCP(O)(O)=O)cc1OC Show InChI InChI=1S/C17H29BrNO5P/c1-3-4-5-6-9-24-17-15(18)11-14(12-16(17)23-2)13-19-8-7-10-25(20,21)22/h11-12,19H,3-10,13H2,1-2H3,(H2,20,21,22)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.20	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human sphingosine 1-phosphate receptor 5 expressed in CHO cells was determined by using [33P]-S1P as radioligand				Bioorg Med Chem Lett 14: 3501-5 (2004) Article DOI: 10.1016/j.bmcl.2004.04.070 BindingDB Entry DOI: 10.7270/Q2W66K76
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human))	BDBM50148428 (CHEMBL325247 | [3-(3-Bromo-4-hexyloxy-5-methoxy-be...) Show SMILES CCCCCCOc1c(Br)cc(CNCCCP(O)(O)=O)cc1OC Show InChI InChI=1S/C17H29BrNO5P/c1-3-4-5-6-9-24-17-15(18)11-14(12-16(17)23-2)13-19-8-7-10-25(20,21)22/h11-12,19H,3-10,13H2,1-2H3,(H2,20,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.30	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human sphingosine 1-phosphate receptor 1 expressed in CHO cells was determined by using [33P]-S1P as radioligand				Bioorg Med Chem Lett 14: 3501-5 (2004) Article DOI: 10.1016/j.bmcl.2004.04.070 BindingDB Entry DOI: 10.7270/Q2W66K76
					More data for this Ligand-Target Pair
Lysophosphatidic acid receptor 2 (Homo sapiens (Human))	BDBM50148428 (CHEMBL325247 | [3-(3-Bromo-4-hexyloxy-5-methoxy-be...) Show SMILES CCCCCCOc1c(Br)cc(CNCCCP(O)(O)=O)cc1OC Show InChI InChI=1S/C17H29BrNO5P/c1-3-4-5-6-9-24-17-15(18)11-14(12-16(17)23-2)13-19-8-7-10-25(20,21)22/h11-12,19H,3-10,13H2,1-2H3,(H2,20,21,22)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligand				Bioorg Med Chem Lett 14: 3501-5 (2004) Article DOI: 10.1016/j.bmcl.2004.04.070 BindingDB Entry DOI: 10.7270/Q2W66K76
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 2 (Homo sapiens (Human))	BDBM50148428 (CHEMBL325247 | [3-(3-Bromo-4-hexyloxy-5-methoxy-be...) Show SMILES CCCCCCOc1c(Br)cc(CNCCCP(O)(O)=O)cc1OC Show InChI InChI=1S/C17H29BrNO5P/c1-3-4-5-6-9-24-17-15(18)11-14(12-16(17)23-2)13-19-8-7-10-25(20,21)22/h11-12,19H,3-10,13H2,1-2H3,(H2,20,21,22)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human sphingosine 1-phosphate receptor 2 expressed in CHO cells was determined by using [33P]-S1P as radioligand				Bioorg Med Chem Lett 14: 3501-5 (2004) Article DOI: 10.1016/j.bmcl.2004.04.070 BindingDB Entry DOI: 10.7270/Q2W66K76
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 3 (Homo sapiens (Human))	BDBM50148428 (CHEMBL325247 | [3-(3-Bromo-4-hexyloxy-5-methoxy-be...) Show SMILES CCCCCCOc1c(Br)cc(CNCCCP(O)(O)=O)cc1OC Show InChI InChI=1S/C17H29BrNO5P/c1-3-4-5-6-9-24-17-15(18)11-14(12-16(17)23-2)13-19-8-7-10-25(20,21)22/h11-12,19H,3-10,13H2,1-2H3,(H2,20,21,22)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	8.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human sphingosine 1-phosphate receptor 3 expressed in CHO cells was determined by using [33P]-S1P as radioligand				Bioorg Med Chem Lett 14: 3501-5 (2004) Article DOI: 10.1016/j.bmcl.2004.04.070 BindingDB Entry DOI: 10.7270/Q2W66K76
					More data for this Ligand-Target Pair