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| Cell (A) | Syringe (B) | Cell Links | Syringe Links | Cell + Syr Links | ΔG° kJ/mole | -TΔS° kJ/mole | ΔH° kJ/mole | log K | pH | Temp °C |
|---|---|---|---|---|---|---|---|---|---|---|
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM16238 (2-(2-{[(4-bromo-2-fluorophenyl)methyl]carbamoyl}-5...) | GoogleScholar PDB | DrugBank MMDB PC cid PC sid PDB | -42.7 | 19.4 | -62.1 | 7.50 | 8 | 24.9 | |
University of Marburg | J Mol Biol 368: 618-38 (2007) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM228822 (ALR2 inhibitor, 11) | GoogleScholar PDB | PC cid PC sid PDB | -43.5 | -12.3 | -55.8 | 10.6 | 8 | 24.9 | |
Philipps-Universität Marburg | ACS Chem Biol 12: 1397-1415 (2017) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM16239 (2-(5-chloro-2-{[(3-nitrophenyl)methyl]carbamoyl}ph...) | GoogleScholar PDB | DrugBank MMDB PC cid PC sid PDB | -42.2 | 36.9 | -79.1 | 7.40 | 8 | 24.9 | |
University of Marburg | J Mol Biol 368: 618-38 (2007) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM16512 ((2S,4S)-6-fluoro-2',5'-dioxo-2,3-dihydrospiro[1-be...) | GoogleScholar PDB | MMDB PC cid PC sid PDB | -46.7 | 28.8 | -75.5 | 8.18 | 8 | 24.9 | |
UMR 7104 du CNRS | J Med Chem 48: 5659-65 (2005) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM16312 ((4S)-6-fluoro-2,3-dihydrospiro[1-benzopyran-4,4'-i...) | GoogleScholar PDB | CHEBI DrugBank MMDB PC cid PC sid PDB | -37.9 | 13.9 | -51.8 | 6.65 | 8 | 24.9 | |
UMR 7104 du CNRS | J Med Chem 48: 5659-65 (2005) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM16233 (4-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butanoic...) | GoogleScholar PDB | CHEBI MMDB PC cid PC sid PDB | -35.4 | -9.80 | -25.6 | 6.22 | 8 | 24.9 | |
University of Marburg | J Mol Biol 368: 618-38 (2007) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM228823 (2-(2-Carbamoyl-5-fluorophenoxy)acetic acid (4)) | GoogleScholar PDB | PC cid PC sid PDB | -29.6 | -5.66 | -35.4 | 8.18 | 8 | 24.9 | |
Philipps-Universität Marburg | ACS Chem Biol 12: 1397-1415 (2017) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM228824 (2-(5-Fluoro-2-(prop-2-yn-1-ylcarbamoyl)phenoxy)ace...) | GoogleScholar PDB | PC cid PC sid PDB | -31.5 | -14.7 | -46.2 | 8.55 | 8 | 24.9 | |
Philipps-Universität Marburg | ACS Chem Biol 12: 1397-1415 (2017) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM228820 (2-(2-(Benzylcarbamoyl)-5-fluorophenoxy)acetic acid...) | GoogleScholar PDB | PC cid PC sid | -29.3 | -0.596 | -29.9 | 8.12 | 8 | 24.9 | |
Philipps-Universität Marburg | ACS Chem Biol 12: 1397-1415 (2017) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM228825 (2-(2-((Benzo[d]thiazol-2-ylmethyl)carbamoyl)-5-flu...) | GoogleScholar PDB | PC cid PC sid PDB | -41.5 | -12.5 | -54 | 10.3 | 8 | 24.9 | |
Philipps-Universität Marburg | ACS Chem Biol 12: 1397-1415 (2017) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM228823 (2-(2-Carbamoyl-5-fluorophenoxy)acetic acid (4)) | GoogleScholar PDB | PC cid PC sid PDB | -29.4 | -9.54 | -39 | 8.14 | 8 | 24.9 | |
Philipps-Universität Marburg | ACS Chem Biol 12: 1397-1415 (2017) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM228820 (2-(2-(Benzylcarbamoyl)-5-fluorophenoxy)acetic acid...) | GoogleScholar PDB | PC cid PC sid | -28.8 | -1.79 | -30.6 | 8.04 | 8 | 24.9 | |
Philipps-Universität Marburg | ACS Chem Biol 12: 1397-1415 (2017) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM228826 (3-((2-(Carboxymethoxy)-4-fluorobenzamido)methyl)be...) | GoogleScholar PDB | PC cid PC sid PDB | -25.4 | -11.0 | -36.4 | 7.44 | 8 | 24.9 | |
Philipps-Universität Marburg | ACS Chem Biol 12: 1397-1415 (2017) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM228825 (2-(2-((Benzo[d]thiazol-2-ylmethyl)carbamoyl)-5-flu...) | GoogleScholar PDB | PC cid PC sid PDB | -41.7 | -8.94 | -50.6 | n/a | 8 | 24.9 | |
Philipps-Universität Marburg | ACS Chem Biol 12: 1397-1415 (2017) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM228821 (ALR2 inhibitor, 8) | GoogleScholar PDB | PC cid PC sid | -44.3 | -21.3 | -65.6 | 10.7 | 8 | 24.9 | |
Philipps-Universität Marburg | ACS Chem Biol 12: 1397-1415 (2017) | |||||||||
| Aldose reductase (AR) (Homo sapiens (Human)) | BDBM16235 (2-{[5-(5-nitrofuran-2-yl)-1,3,4-oxadiazol-2-yl]sul...) | GoogleScholar PDB | CHEBI DrugBank MMDB PC cid PC sid PDB | -31.3 | -22.6 | -8.70 | 5.49 | 8 | 24.9 | |
University of Marburg | J Mol Biol 368: 618-38 (2007) | |||||||||
