BDBM50073257 CHEMBL325499::{2-[(1S,2R,3S,4S)-1-Benzyl-2,3-dihydroxy-4-(3-hydroxy-benzoylamino)-5-phenyl-pentylcarbamoyl]-phenyl}-carbamic acid pyridin-2-ylmethyl ester
SMILES: O[C@@H]([C@H](Cc1ccccc1)NC(=O)c1cccc(O)c1)[C@H](O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1NC(=O)OCc1ccccn1
InChI Key: InChIKey=QMFFUYFALTVNOP-SKXFTCKDSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Human immunodeficiency virus type 1 protease (Human immunodeficiency virus type 1) | BDBM50073257 (CHEMBL325499 | {2-[(1S,2R,3S,4S)-1-Benzyl-2,3-dihy...) | PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | 1.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
AIDS Drug Screening and Development Laboratory, SA Curated by ChEMBL | Assay Description Inhibitory activity against HIV protease | Bioorg Med Chem Lett 8: 3537-42 (1999) BindingDB Entry DOI: 10.7270/Q2HM57MB | |||||||||||
More data for this Ligand-Target Pair |