BDBM43892 6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]-3-(4-fluorobenzyl)triazolo[4,5-d]pyrimidin-7-one::6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]-3-[(4-fluorophenyl)methyl]-[1,2,3]triazolo[4,5-d]pyrimidin-7-one::6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-3-[(4-fluorophenyl)methyl]-7-triazolo[4,5-d]pyrimidinone::6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-3-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-one::VU0178663-2-D5::cid_3239682
SMILES: Fc1ccc(Cn2nnc3c2ncn(CC(=O)N2CCCc4ccccc24)c3=O)cc1
InChI Key: InChIKey=VRBFMGLGLISVTD-UHFFFAOYSA-N
Data: 1 IC50
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)) | BDBM43892 (6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]-...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 1.30E+3 | n/a | n/a | 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/Q2ZP44H3 | |||||||||||
More data for this Ligand-Target Pair |