BDBM237039 US9388197, 41

SMILES: Clc1cc2CCC(NC(=O)C3CCOc4ncsc34)c2c(Cl)c1

InChI Key: InChIKey=OLPOMNJRPMMVAZ-UHFFFAOYSA-N

Data: 1 IC50

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 = 237039   

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
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM237039 (US9388197, 41) Show SMILES Clc1cc2CCC(NC(=O)C3CCOc4ncsc34)c2c(Cl)c1 Show InChI InChI=1S/C16H14Cl2N2O2S/c17-9-5-8-1-2-12(13(8)11(18)6-9)20-15(21)10-3-4-22-16-14(10)23-7-19-16/h5-7,10,12H,1-4H2,(H,20,21)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.80	n/a	n/a	n/a	n/a	n/a	37
ACTELION PHARMACEUTICALS LTD. US Patent					Assay Description Cells were grown to confluency in adherent culture at 37° C. in a humidified 5% CO2 incubator (split 1/5 every 3-4 days with DMEM, 10% FCS, 1% Pe...				US Patent US9388197 (2016) BindingDB Entry DOI: 10.7270/Q2FF3R8Z
					More data for this Ligand-Target Pair