Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03955594
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 |
A17![]() | N-cyclopropyl-4-methyl-3-[1-(2- methylphenyl)phthalazin-6-yl]benzamide | A,B,C,D | 3DS6 | 0.71 | ![]() |
L02![]() | 4-[3-(4-CHLOROPHENYL)-1H-PYRAZOL- 5-YL]PIPERIDINE | B,I | 1WAY | 0.76 | ![]() |
PY1![]() | 4-(3-PYRIDIN-2-YL-1H-PYRAZOL-4- YL)QUINOLINE | A | 1PY5 | 0.75 | ![]() |
VC3![]() | 3-(4-nitrophenyl)-1H-pyrazole | A,B,C,D | 2VCZ | 0.76 | ![]() |
SM5![]() | (1E)-5-(1-piperidin-4-yl-3-pyridin- 4-yl-1H-pyrazol-4-yl)-2,3-dihydro- 1H-inden-1-one oxime | A,B | 3D4Q | 0.71 | ![]() |
L15![]() | 2-[4-(3-METHYL-1H-PYRAZOL-4-YL)PHENYL]ETHANAMINE | A | 2UW4 | 0.86 | ![]() |
GVG![]() | 3-METHYL-4-PHENYL-1H-PYRAZOLE | A | 2UW3 | 0.86 | ![]() |
R20![]() | 4-(3-METHYLPHENYL)-1H-1,2,3-TRIAZOLE | A | 2ADU | 0.76 | ![]() |
LZ1![]() | 1H-indazole | A,B | 3E6I | 0.77 | ![]() |
LZ1![]() | 1H-indazole | A | 2VTA | 0.77 | ![]() |
GVN![]() | (2R)-2-(4-CHLOROPHENYL)-2-[4-(1H- PYRAZOL-4-YL)PHENYL]ETHANAMINE | A | 2UW5 | 0.79 | ![]() |
7NI![]() | 7-NITROINDAZOLE | A,B | 1M8E | 0.7 | ![]() |
7NI![]() | 7-NITROINDAZOLE | A,B | 1FOJ | 0.7 | ![]() |
7NI![]() | 7-NITROINDAZOLE | A,B | 1M9K | 0.7 | ![]() |
LL1![]() | 3-pyridin-4-yl-1H-indazole | A | 3DNE | 0.76 | ![]() |
5NI![]() | 5-NITROINDAZOLE | A,B | 1M8I | 0.71 | ![]() |
5NI![]() | 5-NITROINDAZOLE | A,B | 1M9Q | 0.71 | ![]() |
6NI![]() | 6-NITROINDAZOLE | A,B | 1M8H | 0.71 | ![]() |
6NI![]() | 6-NITROINDAZOLE | A,B | 1M9M | 0.71 | ![]() |
FRZ![]() | 5-(2-PHENYLPYRAZOLO[1,5-A]PYRIDIN- 3-YL)-1H-PYRAZOLO[3,4-C]PYRIDAZIN- 3-AMINE | A | 1TVO | 0.71 | ![]() |
GG5![]() | 4-[3-(4-FLUOROPHENYL)-1H-PYRAZOL- 4-YL]PYRIDINE | A | 3HVC | 0.78 | ![]() |
GVP![]() | 4-(4-CHLOROPHENYL)-4-[4-(1H-PYRAZOL- 4-YL)PHENYL]PIPERIDINE | A | 2UW9 | 0.8 | ![]() |
GVP![]() | 4-(4-CHLOROPHENYL)-4-[4-(1H-PYRAZOL- 4-YL)PHENYL]PIPERIDINE | A | 2UW7 | 0.8 | ![]() |
MQ0![]() | (3-AMINOMETHYL-CINNOLIN-4-YL)-(3,3- DIPHENYL-ALLYLIDENE)-AMINE | A,B,C | 3STD | 0.74 | ![]() |
LIG![]() | 3-PYRIDIN-4-YL-2,4-DIHYDRO-INDENO[1,2- .C.]PYRAZOLE | P | 1JVP | 0.76 | ![]() |
GVO![]() | (2S)-2-(4-CHLOROPHENYL)-2-[4-(1H- PYRAZOL-4-YL)PHENYL]ETHANAMINE | A | 2UW6 | 0.79 | ![]() |
5B2![]() | 5-phenyl-1H-indazol-3-amine | A | 3E63 | 0.71 | ![]() |