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BDBM358 (2R,3R,4R,5R)-2,5-bis(benzyloxy)-3,4-dihydroxy-N,N'-bis[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]hexanediamide::1-Valine Methylamide deriv. 11::C2-symmetric compound 8::Diol-Based HIV-1 protease inhibitor 1::symmetric/asymmetric inhibitor 2
SMILES: O[C@H]([C@@H](O)[C@@H](OCc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OCc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
InChI Key: InChIKey=UOHMQWQGAJAUGT-UHFFFAOYSA-N
Data: 6 KI
| Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM358![]() (symmetric/asymmetric inhibitor 2 | (2R,3R,4R,5R)-2...) | GoogleScholar | UniChem | 0.200 | -13.4 | n/a | n/a | n/a | n/a | n/a | 5.0 | 30 | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM358![]() (symmetric/asymmetric inhibitor 2 | (2R,3R,4R,5R)-2...) | GoogleScholar | UniChem | 0.600 | -12.8 | n/a | n/a | n/a | n/a | n/a | 5.0 | 30 | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM358![]() (symmetric/asymmetric inhibitor 2 | (2R,3R,4R,5R)-2...) | GoogleScholar | UniChem | 1.22 | -12.4 | n/a | n/a | n/a | n/a | n/a | 5.0 | 30 | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Plasmepsin I (malaria parasite P. falciparum) | BDBM358![]() (symmetric/asymmetric inhibitor 2 | (2R,3R,4R,5R)-2...) | GoogleScholar | UniChem | 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Plasmepsin II (Plasmodium falciparum) | BDBM358![]() (symmetric/asymmetric inhibitor 2 | (2R,3R,4R,5R)-2...) | GoogleScholar | UniChem | 85 | -9.54 | n/a | n/a | n/a | n/a | n/a | 4.5 | 22 | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Cathepsin D (Human) | BDBM358![]() (symmetric/asymmetric inhibitor 2 | (2R,3R,4R,5R)-2...) | GoogleScholar | UniChem | >2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||