BDBM50069637 CHEMBL3402545

SMILES: CCc1nnc(C(C)NS(=O)(=O)c2ccc(Cl)cc2)n1CC

InChI Key: InChIKey=DCEHBSNHFUVPFD-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 = 50069637   

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))	BDBM50069637 (CHEMBL3402545) Show SMILES CCc1nnc(C(C)NS(=O)(=O)c2ccc(Cl)cc2)n1CC Show InChI InChI=1S/C14H19ClN4O2S/c1-4-13-16-17-14(19(13)5-2)10(3)18-22(20,21)12-8-6-11(15)7-9-12/h6-10,18H,4-5H2,1-3H3	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	410	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Antagonist activity against S1P1R in human U2OS cells expressing beta-arrestin/green fluorescent protein assessed as effect on S1P-induced beta-arres...				Bioorg Med Chem Lett 25: 2041-5 (2015) Article DOI: 10.1016/j.bmcl.2015.03.095 BindingDB Entry DOI: 10.7270/Q22F7Q3D
					More data for this Ligand-Target Pair