Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00042024
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 |
RMA | N-[(1S)-2,3-DIHYDRO-1H-INDEN-1- YL]-N-METHYL-N-PROP-2-YNYLAMINE | A,B | 1S3B | 0.72 |  |
N2T | (2S)-4-(2,5-DIFLUOROPHENYL)-N-METHYL- 2-PHENYL-N-PIPERIDIN-4-YL-2,5-DIHYDRO- 1H-PYRROLE-1-CARBOXAMIDE | A,B | 2FKY | 0.7 | |
PZQ | PRAZIQUANTEL | A | 1GTB | 0.77 | |
BTM | N-benzyl-N,N-diethylethanaminium | A,B | 2Q9Y | 0.77 | |
1PC | 1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE | B,C | 2PCP | 0.84 | |
PHC | N-METHYL-N-(METHYLBENZYL)FORMAMIDE | A,B | 1BIM | 0.71 | |
| PHC | N-METHYL-N-(METHYLBENZYL)FORMAMIDE | A,B | 1BIL | 0.71 | |
271 | N-methyl-1-phenylmethanamine | X | 2RBT | 0.71 | |
DPK | DEPRENYL | A,B | 2BYB | 0.75 | |
MM2 | 1,1'-[1,4-PHENYLENEBIS(METHYLENE)]BIS[1,4,8,11- TETRAAZA-CYCLOTETRADECANE]CU(II)2 | A | 1YIL | 0.75 | |
MM5 | 1,1'-[1,4-PHENYLENEBIS(METHYLENE)]BIS[1,4,8,11- TETRAAZACYCLOTETRADECANE]NI(II) | A | 2H9J | 0.75 | |
N5T | (2S)-4-(2,5-DIFLUOROPHENYL)-N,N- DIMETHYL-2-PHENYL-2,5-DIHYDRO-1H- PYRROLE-1-CARBOXAMIDE | A,B | 2FL6 | 0.71 | |
L18 | (2S)-1-methyl-2-[(2S,4R)-2-methyl- 4-phenylpentyl]piperidine | A | 2JJG | 0.78 | |