null
SMILES: Cc1cc(O)cc(C)c1CNC(=O)[C@@H](C[C@@H](O)CN1CCN(C[C@@H]1C(=O)NC(C)(C)C)S(=O)(=O)c1ccc2N(CCc2c1)c1ncccn1)Cc1ccccc1
InChI Key: InChIKey=UPTRZAHECQTLFN-GNNMJGRWSA-N
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) | BDBM50118962 ((R)-1-[(3R,5R)-2-Hydroxy-4-(4-hydroxy-2,6-dimethyl...) | PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | PubMed | n/a | n/a | 0.200 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories Curated by ChEMBL | Assay Description Ability to prevent cleavage of acompound by the HIV protease wild-type enzyme | Bioorg Med Chem Lett 12: 2855-8 (2002) BindingDB Entry DOI: 10.7270/Q2TB167H | |||||||||||
More data for this Ligand-Target Pair |