null
SMILES: CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)S(=O)(=O)c1ccccc1
InChI Key: InChIKey=KRKOLCVTGDIAEB-RRPNLBNLSA-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) | BDBM50036251![]() (CHEMBL141265 | [(1S,2R)-3-(Benzenesulfonyl-isobuty...) | PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | 3.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Discovery Research Curated by ChEMBL | Assay Description Binding affinity of the compound for HIV-1 protease was determined in vitro | J Med Chem 38: 581-4 (1995) BindingDB Entry DOI: 10.7270/Q2SF2V61 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM50036251![]() (CHEMBL141265 | [(1S,2R)-3-(Benzenesulfonyl-isobuty...) | PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Patents Similars | Article | n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibitory activity against HIV-1 protease in spectrofluorometric assay | Bioorg Med Chem Lett 6: 445-450 (1996) Article DOI: 10.1016/0960-894X(96)00035-2 BindingDB Entry DOI: 10.7270/Q2R78F6Z | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM50036251![]() (CHEMBL141265 | [(1S,2R)-3-(Benzenesulfonyl-isobuty...) | PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Searle Discovery Research Curated by ChEMBL | Assay Description Ability of the compound to inhibit HIV-1 protease was determined using spectrofluorometric assay | J Med Chem 38: 581-4 (1995) BindingDB Entry DOI: 10.7270/Q2SF2V61 | |||||||||||
More data for this Ligand-Target Pair |