BDBM44183 5-[1-(4-Fluoro-benzenesulfonyl)-piperidin-4-yl]-3-(4-methyl-benzyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol::5-[1-(4-fluorophenyl)sulfonyl-4-piperidinyl]-3-[(4-methylphenyl)methyl]-2H-triazolo[4,5-d]pyrimidin-7-one::5-[1-(4-fluorophenyl)sulfonyl-4-piperidyl]-3-(4-methylbenzyl)-2H-triazolo[4,5-d]pyrimidin-7-one::5-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-3-[(4-methylphenyl)methyl]-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one::5-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-3-[(4-methylphenyl)methyl]-2H-triazolo[4,5-d]pyrimidin-7-one::MLS000035432::SMR000007394::cid_655851

SMILES: Cc1ccc(Cn2nnc3c2nc([nH]c3=O)C2CCN(CC2)S(=O)(=O)c2ccc(F)cc2)cc1

InChI Key: InChIKey=HXJTXZYYTROGNC-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 = 44183   

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
electroneutral potassium-chloride cotransporter KCC2 (Homo sapiens (Human))	BDBM44183 (5-[1-(4-Fluoro-benzenesulfonyl)-piperidin-4-yl]-3-...) Show SMILES Cc1ccc(Cn2nnc3c2nc([nH]c3=O)C2CCN(CC2)S(=O)(=O)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C23H23FN6O3S/c1-15-2-4-16(5-3-15)14-30-22-20(27-28-30)23(31)26-21(25-22)17-10-12-29(13-11-17)34(32,33)19-8-6-18(24)7-9-19/h2-9,17H,10-14H2,1H3,(H,25,26,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.11E+4	n/a	n/a	n/a	n/a
Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Curated by PubChem BioAssay					Assay Description Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Assay Provider: Eric Delpire Assay Provider Affliation: Vanderbilt University Gr...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2Q52N1X
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