BDBM65854 4-[[4-ethyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile::4-[[4-ethyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile::4-[[[4-ethyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]methyl]benzonitrile::MLS000083131::SMR000046276::cid_665176

SMILES: CCn1c(COc2ccccc2)nnc1SCc1ccc(cc1)C#N

InChI Key: InChIKey=RNGHWMDYNNVLLB-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 = 65854   

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
inward rectifier potassium channel 2 (Mus musculus)	BDBM65854 (4-[[4-ethyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]s...) Show SMILES CCn1c(COc2ccccc2)nnc1SCc1ccc(cc1)C#N Show InChI InChI=1S/C19H18N4OS/c1-2-23-18(13-24-17-6-4-3-5-7-17)21-22-19(23)25-14-16-10-8-15(12-20)9-11-16/h3-11H,2,13-14H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	4.83E+4	n/a	n/a	n/a	n/a	n/a	n/a
Johns Hopkins Ion Channel Center Curated by PubChem BioAssay					Assay Description Data Source: Johns Hopkins Ion Channel Center (JHICC) BioAssay Type: Confirmatory, Confirmatory Screening, Multiple Concentration Activity Observed. ...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q23R0R98
					More data for this Ligand-Target Pair