BDBM50281324 ((S)-1-{N'-[(2S,3S)-3-((S)-2-Benzyloxycarbonylamino-3-methyl-butyrylamino)-2-hydroxy-4-phenyl-butyl]-N'-isobutyl-hydrazinocarbonyl}-2-methyl-propyl)-carbamic acid benzyl ester::CHEMBL317204
SMILES: CC(C)CN(C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C
InChI Key: InChIKey=MXKSHMATDQKZDB-ZYADHFCISA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Human immunodeficiency virus type 1 protease (Human immunodeficiency virus type 1) | BDBM50281324 (((S)-1-{N'-[(2S,3S)-3-((S)-2-Benzyloxycarbonylamin...) | PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article | n/a | n/a | 10 | n/a | n/a | n/a | n/a | 6.0 | n/a |
TBA Curated by ChEMBL | Assay Description In vitro inhibition of HIV-1 protease at pH 6 using 164 microM peptide substrate | Bioorg Med Chem Lett 3: 2837-2842 (1993) Article DOI: 10.1016/S0960-894X(01)80775-7 BindingDB Entry DOI: 10.7270/Q22F7NC5 | |||||||||||
More data for this Ligand-Target Pair |