BDBM50349741 CHEMBL1809168::US8822447, 139::US9771375, Example 139
SMILES: CSc1nn(-c2ccc(F)cc2)c2cc(ccc12)C1=CCNCC1
InChI Key: InChIKey=UBRBWTYCZSKZLM-UHFFFAOYSA-N
Data: 3 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Ketohexokinase (KHK) Isoform C (Homo sapiens (Human)) | BDBM50349741 (CHEMBL1809168 | US8822447, 139 | US9771375, Exampl...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | US Patent | n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | 25 |
Janssen Pharmaceutica NV US Patent | Assay Description An enzymatic assay was developed to measure KHK-mediated conversion of D-fructose to Fructose-1-P (F-1-P) using High Throughput Mass Spectroscopy (HT... | US Patent US8822447 (2014) BindingDB Entry DOI: 10.7270/Q2M0443Q | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Ketohexokinase (KHK) Isoform C (Homo sapiens (Human)) | BDBM50349741 (CHEMBL1809168 | US8822447, 139 | US9771375, Exampl...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | US Patent | n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | n/a |
Janssen Pharmaceutica NV US Patent | Assay Description An enzymatic assay was developed to measure KHK-mediated conversion of D-fructose to Fructose-1-P (F-1-P) using High Throughput Mass Spectroscopy (HT... | US Patent US9771375 (2017) BindingDB Entry DOI: 10.7270/Q20R9RJW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Ketohexokinase (KHK) Isoform C (Homo sapiens (Human)) | BDBM50349741 (CHEMBL1809168 | US8822447, 139 | US9771375, Exampl...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 23 | n/a | n/a | n/a | n/a | n/a | n/a |
Johnson& Johnson Pharmaceutical Research and Development Curated by ChEMBL | Assay Description Inhibition of KHK-mediated conversion of D-fructose to fructose-1-phosphate after 60 mins by high throughput mass spectrometry analysis | Bioorg Med Chem Lett 21: 4762-7 (2011) Article DOI: 10.1016/j.bmcl.2011.06.067 BindingDB Entry DOI: 10.7270/Q2M61KMR | |||||||||||
More data for this Ligand-Target Pair |