BDBM50291059 6-(2-Cyclopropyl-1-cyclopropylmethyl-ethyl)-3-{cyclopropyl-[3-(4-fluoro-benzenesulfonylmethyl)-phenyl]-methyl}-4-hydroxy-pyran-2-one::CHEMBL131821
SMILES: Oc1cc(oc(=O)c1C(C1CC1)c1cccc(CS(=O)(=O)c2ccc(F)cc2)c1)C(CC1CC1)CC1CC1
InChI Key: InChIKey=WYOZCRBEGUDHNS-UHFFFAOYSA-N
Data: 1 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM50291059 (6-(2-Cyclopropyl-1-cyclopropylmethyl-ethyl)-3-{cyc...) | PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article | 19 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of HIV-1 protease. | Bioorg Med Chem Lett 7: 399-402 (1997) Article DOI: 10.1016/S0960-894X(97)00031-0 BindingDB Entry DOI: 10.7270/Q21R6QH6 | |||||||||||
More data for this Ligand-Target Pair |