BDBM50139593 (S)-3-{13-[(2R,5S,1'R,3'R)-5'-((R)-1-Hydroxy-undecyl)-octahydro-[2,2']bifuranyl-5-yl]-tridecyl}-5-methyl-5H-furan-2-one::CHEMBL164819
SMILES: CCCCCCCCCC[C@@H](O)[C@H]1CC[C@@H](O1)[C@H]1CC[C@H](CCCCCCCCCCCCCC2=C[C@H](C)OC2=O)O1
InChI Key: InChIKey=ZTUMLIYWQSQXKN-CXPQHEJVSA-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 |
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Mitochondrial complex I; NADH oxidoreductase (Bos taurus) | BDBM50139593 ((S)-3-{13-[(2R,5S,1'R,3'R)-5'-((R)-1-Hydroxy-undec...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 2.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University Curated by ChEMBL | Assay Description Inhibitory concentration needed to halve the control NADH oxidase activity in bovine heart submitochondrial particles (SMP) | Bioorg Med Chem Lett 14: 779-82 (2004) BindingDB Entry DOI: 10.7270/Q2ZC8290 | |||||||||||
More data for this Ligand-Target Pair |