Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01771773
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 |
AS3 | 4-METHYL-6-PROPYLPYRIDIN-2-AMINE | A,B | 3E6N | 0.71 | |
4AP | 4-AMINOPYRIDINE | A | 1AEG | 0.71 | |
SB9 | HYDROXY[3-(6-METHYLPYRIDIN-2-YL)PROPYL]FORMAMIDE | P | 2AIE | 0.8 | |
APY | 2-AMINOMETHYL-PYRIDINE | A,B,I | 1HIV | 0.73 | |
APY | 2-AMINOMETHYL-PYRIDINE | I | 1IVP | 0.73 | |
275 | 5-amino-1,2-dimethylpyridinium | X | 2RBW | 0.72 | |
PRL | PROFLAVIN | H,I | 1BCU | 0.7 | |
PRL | PROFLAVIN | A,B,D,E | 1QVT | 0.7 | |
PRL | PROFLAVIN | A,B | 2KD4 | 0.7 | |
PRL | PROFLAVIN | A | 1QVU | 0.7 | |
286 | 2-ethenyl-1-methylpyridinium | X | 2RC2 | 0.74 | |
HBP | 1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME | A,B | 2GYV | 0.74 | |
HBP | 1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME | A,B | 2JF0 | 0.74 | |
THA | TACRINE | A,B | 2AOW | 0.72 | |
THA | TACRINE | A,B,C,D,E,F | 1MX1 | 0.72 | |
THA | TACRINE | A,B | 2AOX | 0.72 | |
THA | TACRINE | A | 1ACJ | 0.72 |