BDBM50005695 1-(2-Hydroxy-3-{3-methyl-2-[2-(naphthalen-1-yloxy)-acetylamino]-butyrylamino}-4-phenyl-butyryl)-pyrrolidine-2-carboxylic acid tert-butylamide::BDBM50407028::CHEMBL283522::CHEMBL335391
SMILES: CC(C)[C@H](NC(=O)COc1cccc2ccccc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)C(=O)N1CCC[C@H]1C(=O)NC(C)(C)C
InChI Key: InChIKey=NNQLVRVACLOQHS-FSPAFBPESA-N
Data: 2 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) | BDBM50005695 (1-(2-Hydroxy-3-{3-methyl-2-[2-(naphthalen-1-yloxy)...) | PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 1.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Washington University Curated by ChEMBL | Assay Description Inhibitory potency against HIV-1 protease | J Med Chem 36: 4152-60 (1994) BindingDB Entry DOI: 10.7270/Q2PK0HCT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Human immunodeficiency virus type 1 protease (Human immunodeficiency virus type 1) | BDBM50005695 (1-(2-Hydroxy-3-{3-methyl-2-[2-(naphthalen-1-yloxy)...) | PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 1.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Syntex Research Canada Curated by ChEMBL | Assay Description Inhibitory activity of the Compound was tested against HIV protease enzyme. | J Med Chem 35: 1318-20 (1992) BindingDB Entry DOI: 10.7270/Q2W959T5 | |||||||||||
More data for this Ligand-Target Pair |