BDBM80777 (6E)-6-[[(4-amino-1,2,4-triazol-3-yl)hydrazo]methylidene]-2,4-dibromo-1-cyclohexa-2,4-dienone;hydrochloride::(6E)-6-[[2-(4-amino-1,2,4-triazol-3-yl)hydrazinyl]methylidene]-2,4-dibromocyclohexa-2,4-dien-1-one;hydrochloride::(6E)-6-[[2-(4-azanyl-1,2,4-triazol-3-yl)hydrazinyl]methylidene]-2,4-bis(bromanyl)cyclohexa-2,4-dien-1-one;hydrochloride::(6E)-6-[[N'-(4-amino-1,2,4-triazol-3-yl)hydrazino]methylene]-2,4-dibromo-cyclohexa-2,4-dien-1-one;hydrochloride::3,5-dibromo-2-hydroxybenzaldehyde (4-amino-4H-1,2,4-triazol-3-yl)hydrazone::MLS000539822::SMR000161885::cid_11958783
SMILES: Nn1cnnc1N=NCc1cc(Br)cc(Br)c1O
InChI Key: InChIKey=XPLHPBZBZOSSHR-UHFFFAOYSA-N
Data: 2 EC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Hexokinase-1 (Homo sapiens (Human)) | BDBM80777 ((6E)-6-[[(4-amino-1,2,4-triazol-3-yl)hydrazo]methy...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | PCBioAssay | n/a | n/a | n/a | n/a | 4.23E+4 | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2765CSM | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Hexokinase HKDC1 [W721R] (Homo sapiens (Human)) | BDBM80777 ((6E)-6-[[(4-amino-1,2,4-triazol-3-yl)hydrazo]methy...) | GoogleScholar AffyNet | PC cid PC sid UniChem | PCBioAssay | n/a | n/a | n/a | n/a | >8.00E+4 | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2R78CQV | |||||||||||
More data for this Ligand-Target Pair |