BDBM123454 US8741923, 11

SMILES: CC1CCCCN1c1ccc(cc1NS(C)(=O)=O)-c1nc(no1)-c1ccc2CCNCc2c1

InChI Key: InChIKey=XRVCQYWACVYGAA-UHFFFAOYSA-N

Data: 1 KI

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 = 123454   

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))	BDBM123454 (US8741923, 11) Show SMILES CC1CCCCN1c1ccc(cc1NS(C)(=O)=O)-c1nc(no1)-c1ccc2CCNCc2c1 Show InChI InChI=1S/C24H29N5O3S/c1-16-5-3-4-12-29(16)22-9-8-19(14-21(22)28-33(2,30)31)24-26-23(27-32-24)18-7-6-17-10-11-25-15-20(17)13-18/h6-9,13-14,16,25,28H,3-5,10-12,15H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	4	-10.6	n/a	n/a	n/a	n/a	n/a	7.4	4
Merck Serono SA US Patent					Assay Description Receptor binding assay: Membranes were prepared from CHO cells expressing S1P1 or S1P3 for use in ligand and 35S-GTPγS binding studies. Cells we...				US Patent US8741923 (2014) BindingDB Entry DOI: 10.7270/Q2PK0DVV
					More data for this Ligand-Target Pair