BDBM50226166 CHEMBL258583::F(4-Fluoro)VAE::F(4-fluro)VAE
SMILES: CC(C)[C@H](NC(=O)[C@@H](N)Cc1ccc(F)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(O)=O
InChI Key: InChIKey=HREKBPJJOGCVRC-RPZXMPESSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3-hydroxy-3-methylglutaryl-coenzyme A reductase (Mesocricetus auratus) | BDBM50226166 (CHEMBL258583 | F(4-Fluoro)VAE | F(4-fluro)VAE) | PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 3.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Korea Food Research Institute Curated by ChEMBL | Assay Description Inhibition of Syrian hamster HMGR | Bioorg Med Chem 16: 1309-18 (2008) Article DOI: 10.1016/j.bmc.2007.10.064 BindingDB Entry DOI: 10.7270/Q28P61D2 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
3-hydroxy-3-methylglutaryl-coenzyme A reductase (HMG-CoA) (Homo sapiens (Human)) | BDBM50226166 (CHEMBL258583 | F(4-Fluoro)VAE | F(4-fluro)VAE) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 3.84E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of the Chemistry of Plant Substances Curated by ChEMBL | Assay Description Inhibition of HMG-CoA reductase by spectrophotometry | Bioorg Med Chem 18: 4300-9 (2010) Article DOI: 10.1016/j.bmc.2010.04.090 BindingDB Entry DOI: 10.7270/Q2VM4CFG | |||||||||||
More data for this Ligand-Target Pair |