BDBM50148349 (3-Octadec-9-enoylamino-propionyl)-phosphonothioic acid::CHEMBL117798

SMILES: CCCCCCCC\C=C/CCCCCCCC(=O)NCCC(=O)P(O)(O)=S

InChI Key: InChIKey=RULDNVDOWBRXSL-KTKRTIGZSA-N

Data: 3 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 3 hits for monomerid = 50148349   

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
Lysophosphatidic acid receptor Edg-4 (Homo sapiens (Human))	BDBM50148349 ((3-Octadec-9-enoylamino-propionyl)-phosphonothioic...) Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)NCCC(=O)P(O)(O)=S Show InChI InChI=1S/C21H40NO4PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)22-19-18-21(24)27(25,26)28/h9-10H,2-8,11-19H2,1H3,(H,22,23)(H2,25,26,28)/b10-9-	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	108	n/a	n/a	n/a	n/a
Oxford University Curated by ChEMBL					Assay Description Agonistic activity against lysophosphatidic acid receptor 2 using [35S]-GTP-gammaS as radioligand tested in vitro				Bioorg Med Chem Lett 14: 3473-6 (2004) Article DOI: 10.1016/j.bmcl.2004.04.061 BindingDB Entry DOI: 10.7270/Q2D50MDW
					More data for this Ligand-Target Pair
Lysophosphatidic acid receptor 3 (LPAR3) (Homo sapiens (Human))	BDBM50148349 ((3-Octadec-9-enoylamino-propionyl)-phosphonothioic...) Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)NCCC(=O)P(O)(O)=S Show InChI InChI=1S/C21H40NO4PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)22-19-18-21(24)27(25,26)28/h9-10H,2-8,11-19H2,1H3,(H,22,23)(H2,25,26,28)/b10-9-	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a
Oxford University Curated by ChEMBL					Assay Description Agonistic activity against lysophosphatidic acid receptor 3 using [35S]-GTP-gammaS as radioligand tested in vitro				Bioorg Med Chem Lett 14: 3473-6 (2004) Article DOI: 10.1016/j.bmcl.2004.04.061 BindingDB Entry DOI: 10.7270/Q2D50MDW
					More data for this Ligand-Target Pair
Lysophosphatidic acid receptor 1 (Homo sapiens (Human))	BDBM50148349 ((3-Octadec-9-enoylamino-propionyl)-phosphonothioic...) Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)NCCC(=O)P(O)(O)=S Show InChI InChI=1S/C21H40NO4PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)22-19-18-21(24)27(25,26)28/h9-10H,2-8,11-19H2,1H3,(H,22,23)(H2,25,26,28)/b10-9-	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	40	n/a	n/a	n/a	n/a
Oxford University Curated by ChEMBL					Assay Description Agonistic activity against lysophosphatidic acid receptor 1 using [35S]-GTP-gammaS as radioligand tested in vitro				Bioorg Med Chem Lett 14: 3473-6 (2004) Article DOI: 10.1016/j.bmcl.2004.04.061 BindingDB Entry DOI: 10.7270/Q2D50MDW
					More data for this Ligand-Target Pair