Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03912018
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 |
GVG | 3-METHYL-4-PHENYL-1H-PYRAZOLE | A | 2UW3 | 0.75 | |
THA | TACRINE | A,B | 2AOW | 0.71 | |
THA | TACRINE | A,B,C,D,E,F | 1MX1 | 0.71 | |
THA | TACRINE | A,B | 2AOX | 0.71 | |
THA | TACRINE | A | 1ACJ | 0.71 | |
5B2 | 5-phenyl-1H-indazol-3-amine | A | 3E63 | 0.73 | |
L15 | 2-[4-(3-METHYL-1H-PYRAZOL-4-YL)PHENYL]ETHANAMINE | A | 2UW4 | 0.74 | |
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 | |
DRG | 5,6-DIHYDRO-BENZO[H]CINNOLIN-3- YLAMINE | A | 1P4F | 0.84 | |
MQ0 | (3-AMINOMETHYL-CINNOLIN-4-YL)-(3,3- DIPHENYL-ALLYLIDENE)-AMINE | A,B,C | 3STD | 0.77 | |
MGR | MALACHITE GREEN | A,B | 3BQZ | 0.73 | |
MGR | MALACHITE GREEN | A | 1Q8N | 0.73 | |
MGR | MALACHITE GREEN | A,B | 3BR0 | 0.73 | |
MGR | MALACHITE GREEN | A,D,E | 3BTL | 0.73 | |
MGR | MALACHITE GREEN | A,B,D,E | 3BTC | 0.73 | |
MGR | MALACHITE GREEN | A,B,D,E | 1JUP | 0.73 | |
L02 | 4-[3-(4-CHLOROPHENYL)-1H-PYRAZOL- 5-YL]PIPERIDINE | B,I | 1WAY | 0.7 | |
580 | 3-(4-FLUOROPHENYL)-2-(6-METHYLPYRIDIN- 2-YL)-5,6-DIHYDRO-4H-PYRROLO[1,2- B]PYRAZOLE | A | 1RW8 | 0.71 | |
R20 | 4-(3-METHYLPHENYL)-1H-1,2,3-TRIAZOLE | A | 2ADU | 0.72 | |
CVI | CRYSTAL VIOLET | A,B,D,E | 1JTX | 0.73 | |
BRN | BERENIL | A,B | 268D | 0.73 | |
BRN | BERENIL | A,B | 1D63 | 0.73 | |
BRN | BERENIL | A,D,E | 2GBY | 0.73 | |
BRN | BERENIL | A | 2DBE | 0.73 | |
BRN | BERENIL | A | 2GVR | 0.73 |