BDBM50313331 6-(cyclohexylamino)-N-(2,4-difluorophenyl)pyrimidine-4-carboxamide::CHEMBL1087771

SMILES: Fc1ccc(NC(=O)c2cc(NC3CCCCC3)ncn2)c(F)c1

InChI Key: InChIKey=SEAUMXSNRHUTGH-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 = 50313331   

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))	BDBM50313331 (6-(cyclohexylamino)-N-(2,4-difluorophenyl)pyrimidi...) Show SMILES Fc1ccc(NC(=O)c2cc(NC3CCCCC3)ncn2)c(F)c1 Show InChI InChI=1S/C17H18F2N4O/c18-11-6-7-14(13(19)8-11)23-17(24)15-9-16(21-10-20-15)22-12-4-2-1-3-5-12/h6-10,12H,1-5H2,(H,23,24)(H,20,21,22)	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	>2.00E+4	n/a	n/a	n/a	n/a
Merck Serono SA Curated by ChEMBL					Assay Description Agonist activity at S1P1 receptor expressed in CHO cells after 60 mins by [35S]-GTPgammaS binding assay				Bioorg Med Chem Lett 20: 1516-9 (2010) Article DOI: 10.1016/j.bmcl.2010.01.102 BindingDB Entry DOI: 10.7270/Q2J38SQK
					More data for this Ligand-Target Pair