Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02656854
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 |
QMS | N-(QUINOLIN-8-YL)METHANESULFONAMIDE | A | 2BB7 | 0.72 | |
7NI | 7-NITROINDAZOLE | A,B | 1M8E | 0.76 | |
7NI | 7-NITROINDAZOLE | A,B | 1FOJ | 0.76 | |
7NI | 7-NITROINDAZOLE | A,B | 1M9K | 0.76 | |
PY1 | 4-(3-PYRIDIN-2-YL-1H-PYRAZOL-4- YL)QUINOLINE | A | 1PY5 | 0.75 | |
GG5 | 4-[3-(4-FLUOROPHENYL)-1H-PYRAZOL- 4-YL]PYRIDINE | A | 3HVC | 0.71 | |
L15 | 2-[4-(3-METHYL-1H-PYRAZOL-4-YL)PHENYL]ETHANAMINE | A | 2UW4 | 0.78 | |
LL1 | 3-pyridin-4-yl-1H-indazole | A | 3DNE | 0.75 | |
GVG | 3-METHYL-4-PHENYL-1H-PYRAZOLE | A | 2UW3 | 0.78 | |
R20 | 4-(3-METHYLPHENYL)-1H-1,2,3-TRIAZOLE | A | 2ADU | 0.76 | |
PHN | 1,10-PHENANTHROLINE | A | 1LIH | 0.72 | |
PHN | 1,10-PHENANTHROLINE | A | 2LIG | 0.72 | |
PHN | 1,10-PHENANTHROLINE | A,B | 2FU7 | 0.72 | |
PRL | PROFLAVIN | H,I | 1BCU | 0.72 | |
PRL | PROFLAVIN | A,B,D,E | 1QVT | 0.72 | |
PRL | PROFLAVIN | A,B | 2KD4 | 0.72 | |
PRL | PROFLAVIN | A | 1QVU | 0.72 | |
DRG | 5,6-DIHYDRO-BENZO[H]CINNOLIN-3- YLAMINE | A | 1P4F | 0.75 | |
VC3 | 3-(4-nitrophenyl)-1H-pyrazole | A,B,C,D | 2VCZ | 0.77 | |
5NI | 5-NITROINDAZOLE | A,B | 1M8I | 0.76 | |
5NI | 5-NITROINDAZOLE | A,B | 1M9Q | 0.76 | |
5IQ | ISOQUINOLIN-5-AMINE | A,B | 2F2T | 0.72 | |
DPT | 4,7-DIMETHYL-[1,10]PHENANTHROLINE | A,B | 1I53 | 0.71 | |
6NI | 6-NITROINDAZOLE | A,B | 1M8H | 0.76 | |
6NI | 6-NITROINDAZOLE | A,B | 1M9M | 0.76 | |
A8N | N-9-(1',2',3',4'-TETRAHYDROACRIDINYL)- 1,8-DIAMINOOCTANE | A | 1UT6 | 0.7 | |
LZ1 | 1H-indazole | A,B | 3E6I | 0.83 | |
LZ1 | 1H-indazole | A | 2VTA | 0.83 | |
THA | TACRINE | A,B | 2AOW | 0.73 | |
THA | TACRINE | A,B,C,D,E,F | 1MX1 | 0.73 | |
THA | TACRINE | A,B | 2AOX | 0.73 | |
THA | TACRINE | A | 1ACJ | 0.73 | |
MQ0 | (3-AMINOMETHYL-CINNOLIN-4-YL)-(3,3- DIPHENYL-ALLYLIDENE)-AMINE | A,B,C | 3STD | 0.85 | |
5B2 | 5-phenyl-1H-indazol-3-amine | A | 3E63 | 0.71 |