Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02428094
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 |
L15 | 2-[4-(3-METHYL-1H-PYRAZOL-4-YL)PHENYL]ETHANAMINE | A | 2UW4 | 0.75 | |
GVG | 3-METHYL-4-PHENYL-1H-PYRAZOLE | A | 2UW3 | 0.75 | |
6NI | 6-NITROINDAZOLE | A,B | 1M8H | 0.77 | |
6NI | 6-NITROINDAZOLE | A,B | 1M9M | 0.77 | |
LZ1 | 1H-indazole | A,B | 3E6I | 0.84 | |
LZ1 | 1H-indazole | A | 2VTA | 0.84 | |
5NI | 5-NITROINDAZOLE | A,B | 1M8I | 0.77 | |
5NI | 5-NITROINDAZOLE | A,B | 1M9Q | 0.77 | |
MQ0 | (3-AMINOMETHYL-CINNOLIN-4-YL)-(3,3- DIPHENYL-ALLYLIDENE)-AMINE | A,B,C | 3STD | 0.71 | |
IHH | [4-({4-[(5-cyclopropyl-1H-pyrazol- 3-yl)amino]quinazolin-2-yl}amino)phenyl]acetonitrile | A,B,C,D | 3F6X | 0.72 | |
UN3 | (2-METHYL-5-PHENYL-2H-PYRAZOL-3- YL)-SULFAMIC ACID | A | 2F6W | 0.72 | |
537 | 2,6-DIHYDROANTHRA/1,9-CD/PYRAZOL- 6-ONE | A | 1UKI | 0.77 | |
537 | 2,6-DIHYDROANTHRA/1,9-CD/PYRAZOL- 6-ONE | A | 1PMV | 0.77 | |
537 | 2,6-DIHYDROANTHRA/1,9-CD/PYRAZOL- 6-ONE | A | 2ZMD | 0.77 | |
QPP | N-(5-METHYL-1H-PYRAZOL-3-YL)-2- PHENYLQUINAZOLIN-4-AMINE | A,C | 2JC6 | 0.75 | |
LL1 | 3-pyridin-4-yl-1H-indazole | A | 3DNE | 0.75 | |
5B3 | 4-(3-amino-1H-indazol-5-yl)-N-tert- butylbenzenesulfonamide | A | 3E64 | 0.83 | |
5B2 | 5-phenyl-1H-indazol-3-amine | A | 3E63 | 0.95 | |
P19 | N,N'-DIPHENYLPYRAZOLO[1,5-A][1,3,5]TRIAZINE- 2,4-DIAMINE | A | 2PVH | 0.7 | |
L02 | 4-[3-(4-CHLOROPHENYL)-1H-PYRAZOL- 5-YL]PIPERIDINE | B,I | 1WAY | 0.72 | |
F29 | 1-ALLYL-5-(2-PHENYLPYRAZOLO[1,5- A]PYRIDIN-3-YL)-1H-PYRAZOLO[3,4- C]PYRIDAZIN-3-AMINE | A | 1WZY | 0.7 | |
FRZ | 5-(2-PHENYLPYRAZOLO[1,5-A]PYRIDIN- 3-YL)-1H-PYRAZOLO[3,4-C]PYRIDAZIN- 3-AMINE | A | 1TVO | 0.76 | |
DRG | 5,6-DIHYDRO-BENZO[H]CINNOLIN-3- YLAMINE | A | 1P4F | 0.76 | |
INE | 3-BROMO-7-NITROINDAZOLE | A,B | 1D0O | 0.73 | |
INE | 3-BROMO-7-NITROINDAZOLE | A,B | 1M9R | 0.73 | |
INE | 3-BROMO-7-NITROINDAZOLE | A,B | 1D0C | 0.73 | |
INE | 3-BROMO-7-NITROINDAZOLE | A,B | 1M9T | 0.73 | |
INE | 3-BROMO-7-NITROINDAZOLE | A,B | 1OM5 | 0.73 | |
GVD | [4-({4-[(5-CYCLOPROPYL-1H-PYRAZOL- 3-YL)AMINO]QUINAZOLIN-2-YL}IMINO)CYCLOHEXA- 2,5-DIEN-1-YL]ACETONITRILE | A | 2UV2 | 0.71 | |
GVD | [4-({4-[(5-CYCLOPROPYL-1H-PYRAZOL- 3-YL)AMINO]QUINAZOLIN-2-YL}IMINO)CYCLOHEXA- 2,5-DIEN-1-YL]ACETONITRILE | A,B | 3GGF | 0.71 | |
GVD | [4-({4-[(5-CYCLOPROPYL-1H-PYRAZOL- 3-YL)AMINO]QUINAZOLIN-2-YL}IMINO)CYCLOHEXA- 2,5-DIEN-1-YL]ACETONITRILE | A,B | 2VN9 | 0.71 | |
5B1 | 5-bromo-1H-indazol-3-amine | A | 3E62 | 0.87 | |
7NI | 7-NITROINDAZOLE | A,B | 1M8E | 0.73 | |
7NI | 7-NITROINDAZOLE | A,B | 1FOJ | 0.73 | |
7NI | 7-NITROINDAZOLE | A,B | 1M9K | 0.73 | |
VC3 | 3-(4-nitrophenyl)-1H-pyrazole | A,B,C,D | 2VCZ | 0.73 | |
BRN | BERENIL | A,B | 268D | 0.75 | |
BRN | BERENIL | A,B | 1D63 | 0.75 | |
BRN | BERENIL | A,D,E | 2GBY | 0.75 | |
BRN | BERENIL | A | 2DBE | 0.75 | |
BRN | BERENIL | A | 2GVR | 0.75 | |
IDZ | 3-(1H-BENZIMIDAZOL-2-YL)-1H-INDAZOLE | A | 2C3L | 0.74 | |
DAP | 6-AMIDINE-2-(4-AMIDINO-PHENYL)INDOLE | A | 1D30 | 0.71 | |
DAP | 6-AMIDINE-2-(4-AMIDINO-PHENYL)INDOLE | A | 432D | 0.71 |