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| Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1943 (Carboxamide-Containing 4-Hydroxy-2-pyrone analogue...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet  | PC cid PC sid UniChem Similars | Article PubMed | 4 | -47.5 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1941 (Carboxamide-Containing 4-Hydroxy-2-pyrone analogue...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 15 | -44.2 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1942 (Carboxamide-Containing 4-Hydroxy-2-pyrone analogue...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 19 | -43.6 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1935 (Carboxamide-Containing 4-Hydroxycoumarin analogue ...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 28 | -42.7 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1939 (Carboxamide-Containing 4-Hydroxy-2-pyrone analogue...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | MMDB PC cid PC sid PDB UniChem Similars | PDB Article PubMed | 41 | -41.7 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair |  3D Structure (crystal) | ||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1940 (Carboxamide-Containing 4-Hydroxy-2-pyrone analogue...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 44 | -41.6 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1933 (Carboxamide-Containing 4-Hydroxycoumarin analogue ...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 86 | -39.9 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1929 (4-Hydroxy-3-[1-[3-[[3-(1H-indol-1-yl)-1-oxopropyl]...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 110 | -39.3 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1924 (4-Hydroxy-3-[1-[3-[[[[(tert-butyloxycarbonyl)amino...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | 160 | -38.4 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1934 (3-[cyclopropyl(phenyl)methyl]-4-hydroxy-7-methoxy-...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 170 | -38.2 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1927 (Carboxamide-Containing Phenprocoumon deriv. VIII |...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 170 | -38.2 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1931 (4-Hydroxy-3-[1-3-[[3-[(tert-butyloxycarbonyl)amino...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 170 | -38.2 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1925 (4-Hydroxy-3-[1-[3-[[3-[(tert-butyloxycarbonyl)amin...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 280 | -37.0 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1932 (3-[cyclopropyl(phenyl)methyl]-4-hydroxy-2H-chromen...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 350 | -36.5 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1938 ((2S,3R)-2-({3-[1-(4-hydroxy-2-oxo-2H-chromen-3-yl)...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 400 | -36.2 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1930 (4-hydroxy-7-methoxy-3-(1-phenylpropyl)-2H-chromen-...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | 560 | -35.3 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1926 (4-Hydroxy-3-[1-3-[[4-[(tert-butyloxycarbonyl)amino...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 1.60E+3 | -32.7 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1936 (Alternate Carboxamide-Containing Phenprocoumon der...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 3.40E+3 | -30.9 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1928 (2-[[[3-[1-(4-Hydroxy-2-oxo-2H-1-benzopyran-3-yl)pr...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 3.60E+3 | -30.8 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1) | BDBM1937 (3-[1-[3-[[[(2-Benzimidazolyl)methyl]amino]carbonyl...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 4.40E+3 | -30.3 | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Upjohn | Assay Description HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K... | J Med Chem 38: 3624-37 (1995) Article DOI: 10.1021/jm00018a023 BindingDB Entry DOI: 10.7270/Q22B8W65 | |||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
