Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00027847
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
RIT![]() | RITONAVIR | A,B | 2B60 | 0.7 | ![]() |
RIT![]() | RITONAVIR | B,D | 1N49 | 0.7 | ![]() |
RIT![]() | RITONAVIR | A | 1RL8 | 0.7 | ![]() |
RIT![]() | RITONAVIR | B | 1SH9 | 0.7 | ![]() |
RIT![]() | RITONAVIR | B | 1HXW | 0.7 | ![]() |
FRK![]() | N-[4,5-BIS(4-HYDROXYPHENYL)-1,3- THIAZOL-2-YL]HEXANAMIDE | A | 1WXY | 0.74 | ![]() |
846![]() | [4R--(1ALPHA,5ALPHA,7BETA)]-3-[(CYCLOPROPHYLMETHYL)HEXAHYDRO- 5,6-DIHYDROXY-2-OXO-4,7-BIS(PHENYLMETHYL)- 1H-1,3-DIAZEPIN]METHYL-2-THIAZOLYLBENZAMIDE | B | 1QBU | 0.72 | ![]() |
G37![]() | 2-(BENZYLCARBAMOYL-PHENYLACETYLAMINO- METHYL)-5,5-DIMETHYL-THIAZOLIDINE- 4-CARBOXYLIC ACID 3-[(1H-BENZIMIDAZOL- 2-YLMETHYLCARBAMOYL)-1-BENZYL-2- HYDROXYPROPYL]-AMIDE | A | 1HTG | 0.71 | ![]() |
MZ7![]() | N~2~-ACETYL-N-{(1S,2R)-3-[(1,3- BENZOTHIAZOL-6-YLSULFONYL)(PENTYL)AMINO]- 1-BENZYL-2-HYDROXYPROPYL}-L-VALINAMIDE | A,B | 2QI5 | 0.71 | ![]() |
685![]() | 2-{2-[(3,5-dimethylphenyl)amino]pyrimidin- 4-yl}-N-[(1S)-2-hydroxy-1-methylethyl]- 4-methyl-1,3-thiazole-5-carboxamide | A | 3EMG | 0.71 | ![]() |
MZ5![]() | (2S)-N-[(1S,2R)-3-{(1,3-BENZOTHIAZOL- 6-YLSULFONYL)[(2S)-2-METHYLBUTYL]AMINO}- 1-BENZYL-2-HYDROXYPROPYL]-2-HYDROXY- 3-METHYLBUTANAMIDE | A,B | 2QI3 | 0.72 | ![]() |
L1A![]() | N-(MORPHOLIN-4-YLSULFONYL)-L-PHENYLALANYL- 3-(2-AMINO-1,3-THIAZOL-4-YL)-N- {(1R,2R,3S)-1-[(1R)-CYCLOHEX-3- EN-1-YLMETHYL]-2,3-DIHYDROXY-5- METHYLHEXYL}-L-ALANINAMIDE | A,B | 2G20 | 0.76 | ![]() |
165![]() | N-(BENZYLSULFONYL)-3-CYCLOHEXYLALANYL- N-(2-AMINO-1,3-BENZOTHIAZOL-6-YL)PROLINAMIDE | H,I | 1SB1 | 0.72 | ![]() |