Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00854436
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 |
FNZ![]() | 4-[(1S,2R)-3-(4-FLUOROPHENYL)-2- HYDROXY-1-(1H-1,2,4-TRIAZOL-1-YL)PROPYL]BENZONITRILE | B,H | 2C1P | 0.7 | ![]() |
VGG![]() | 1-tert-butyl-3-(3-methylbenzyl)- 1H-pyrazolo[3,4-d]pyrimidin-4-amine | A | 2WEI | 0.7 | ![]() |
NPZ![]() | 1-methyl-3-naphthalen-2-yl-1H-pyrazolo[3,4- d]pyrimidin-4-amine | A | 3ENE | 0.72 | ![]() |
PP1![]() | 1-TER-BUTYL-3-P-TOLYL-1H-PYRAZOLO[3,4- D]PYRIMIDIN-4-YLAMINE | A | 2IVV | 0.71 | ![]() |
PP1![]() | 1-TER-BUTYL-3-P-TOLYL-1H-PYRAZOLO[3,4- D]PYRIMIDIN-4-YLAMINE | A | 1QCF | 0.71 | ![]() |
PB2![]() | 1-(biphenyl-4-ylmethyl)-1H-imidazole | A,B,C,D | 3G93 | 0.7 | ![]() |
PB2![]() | 1-(biphenyl-4-ylmethyl)-1H-imidazole | A,B,C,D | 3G5N | 0.7 | ![]() |
MTW![]() | HYDROXY(OXO)(3-{[(2Z)-4-[3-(1H- 1,2,4-TRIAZOL-1-YLMETHYL)PHENYL]PYRIMIDIN- 2(5H)-YLIDENE]AMINO}PHENYL)AMMONIUM | A,C | 2C5X | 0.81 | ![]() |
MTW![]() | HYDROXY(OXO)(3-{[(2Z)-4-[3-(1H- 1,2,4-TRIAZOL-1-YLMETHYL)PHENYL]PYRIMIDIN- 2(5H)-YLIDENE]AMINO}PHENYL)AMMONIUM | A | 2C5Y | 0.81 | ![]() |
CL3![]() | N-METHYL-N-[3-(6-PHENYL[1,2,4]TRIAZOLO[4,3- B]PYRIDAZIN-3-YL)PHENYL]ACETAMIDE | A | 1Y2G | 0.71 | ![]() |
VX2![]() | N-cyclohexyl-3-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[4,3- b]pyridazin-6-amine | A | 3BGQ | 0.7 | ![]() |