Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02625772
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 |
NSP | 5-(AMINOMETHYL)-2-METHYLPYRIMIDIN- 4-AMINE | A,B | 1T9B | 0.72 | |
NSP | 5-(AMINOMETHYL)-2-METHYLPYRIMIDIN- 4-AMINE | I | 1E80 | 0.72 | |
PYD | 2,5-DIMETHYL-PYRIMIDIN-4-YLAMINE | A | 4THI | 0.7 | |
YF4 | 5-{[ETHYL(METHYL)AMINO]METHYL}- 2-METHYL-5,6-DIHYDROPYRIMIDIN-4- AMINE | A,B | 1T9A | 0.72 | |
PF1 | N-[(4-AMINO-2-METHYLPYRIMIDIN-5- YL)METHYL]-N-(2-HYDROXYETHYL)FORMAMIDE | A,B | 2QCX | 0.72 | |
YF3 | 2-{[(4-AMINO-2-METHYLPYRIMIDIN- 5-YL)METHYL]AMINO}PROPANE-1-THIOL | A,B | 1T9A | 0.72 | |
YF3 | 2-{[(4-AMINO-2-METHYLPYRIMIDIN- 5-YL)METHYL]AMINO}PROPANE-1-THIOL | A,B | 1T9B | 0.72 | |
PF2 | 2-(4-{(3S,5S)-5-[(3,3-difluoropyrrolidin- 1-yl)carbonyl]pyrrolidin-3-yl}piperazin- 1-yl)pyrimidine | A,B | 3F8S | 0.7 | |
MI1 | 3-{(3R,4R)-4-methyl-3-[methyl(7H- pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin- 1-yl}-3-oxopropanenitrile | A,B | 3FUP | 0.73 | |
MI1 | 3-{(3R,4R)-4-methyl-3-[methyl(7H- pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin- 1-yl}-3-oxopropanenitrile | A | 3EYG | 0.73 | |
YF1 | 2,5-DIMETHYLPYRIMIDIN-4-AMINE | A,B,C,D | 1T9D | 0.7 |