BDBM50357797 CHEMBL1916574

SMILES: COc1ccc(cc1C#N)-c1nc(no1)-c1ccc2N(CCc2c1)C(=O)CCC(O)=O

InChI Key: InChIKey=MTQJKGRFJJNMOZ-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50357797   

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 1 (Homo sapiens (Human))	BDBM50357797 (CHEMBL1916574) Show SMILES COc1ccc(cc1C#N)-c1nc(no1)-c1ccc2N(CCc2c1)C(=O)CCC(O)=O Show InChI InChI=1S/C22H18N4O5/c1-30-18-5-3-15(11-16(18)12-23)22-24-21(25-31-22)14-2-4-17-13(10-14)8-9-26(17)19(27)6-7-20(28)29/h2-5,10-11H,6-9H2,1H3,(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	6.30	n/a	n/a	n/a	n/a
Arena Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at human S1P1 receptor expressed in HEK293 cells assessed as inhibition of forskolin-stimulated cAMP production after 1 hr by HTRF a...				Bioorg Med Chem Lett 21: 6013-8 (2011) Article DOI: 10.1016/j.bmcl.2011.05.110 BindingDB Entry DOI: 10.7270/Q24T6JSB
					More data for this Ligand-Target Pair