Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01206325
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 |
FPB | N-({(2S)-1-[(3R)-3-AMINO-4-(2-FLUOROPHENYL)BUTANOYL]PYRROLIDIN- 2-YL}METHYL)BENZAMIDE | A,B | 2BUB | 0.7 |  |
715 | (2R)-4-OXO-4-[3-(TRIFLUOROMETHYL)- 5,6-DIHYDRO[1,2,4]TRIAZOLO[4,3- A]PYRAZIN-7(8H)-YL]-1-(2,4,5-TRIFLUOROPHENYL)BUTAN- 2-AMINE | A,B | 1X70 | 0.71 | |
C3A | ALLYL {(1S)-1-[(5-{4-[(2,3-DIHYDRO- 1H-INDEN-2-YLAMINO)CARBONYL]BENZYL}- 1,2,4-OXADIAZOL-3-YL)CARBONYL]- 3-PYRROLIDIN-3-YLPROPYL}CARBAMATE | A,B,C,D | 2FS8 | 0.73 | |
| C3A | ALLYL {(1S)-1-[(5-{4-[(2,3-DIHYDRO- 1H-INDEN-2-YLAMINO)CARBONYL]BENZYL}- 1,2,4-OXADIAZOL-3-YL)CARBONYL]- 3-PYRROLIDIN-3-YLPROPYL}CARBAMATE | A,B,C,D | 2FXR | 0.73 | |
C4A | ETHYL {(1S)-5-AMINO-1-[(5-{4-[(2,3- DIHYDRO-1H-INDEN-2-YLAMINO)CARBONYL]BENZYL}- 1,2,4-OXADIAZOL-3-YL)CARBONYL]PENTYL}CARBAMATE | A,B,C,D | 2FS9 | 0.75 | |
448 | (2R)-4-[(8R)-8-METHYL-2-(TRIFLUOROMETHYL)- 5,6-DIHYDRO[1,2,4]TRIAZOLO[1,5- A]PYRAZIN-7(8H)-YL]-4-OXO-1-(2,4,5- TRIFLUOROPHENYL)BUTAN-2-AMINE | A,B,S | 2QOE | 0.7 | |