BDBM128325 US8796280, 14

SMILES: CN(Cc1ccc(cc1)-c1nccnc1NS(=O)(=O)c1ccc(C)cc1)c1ccc(OC(F)(F)F)cc1

InChI Key: InChIKey=WCQQNKBIIBHILP-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 = 128325   

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
G protein-coupled receptor 44 (Homo sapiens (Human))	BDBM128325 (US8796280, 14) Show SMILES CN(Cc1ccc(cc1)-c1nccnc1NS(=O)(=O)c1ccc(C)cc1)c1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C26H23F3N4O3S/c1-18-3-13-23(14-4-18)37(34,35)32-25-24(30-15-16-31-25)20-7-5-19(6-8-20)17-33(2)21-9-11-22(12-10-21)36-26(27,28)29/h3-16H,17H2,1-2H3,(H,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	5.85E+3	-7.13	n/a	n/a	n/a	n/a	n/a	7.4	25
Merck Serono, S.A. US Patent					Assay Description The compounds of the present invention inhibit the binding of PGD2 to its receptor CRTH2. The inhibitory activity can be investigated by a radioligan...				US Patent US8796280 (2014) BindingDB Entry DOI: 10.7270/Q2RV0MCF
					More data for this Ligand-Target Pair