Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00518996
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 |
8PC![]() | 2-(2,4-DICHLOROPHENOXY)-5-(PYRIDIN- 2-YLMETHYL)PHENOL | A,B | 2OP1 | 0.8 | ![]() |
8PC![]() | 2-(2,4-DICHLOROPHENOXY)-5-(PYRIDIN- 2-YLMETHYL)PHENOL | A,B,C,D | 3FNE | 0.8 | ![]() |
LO2![]() | 2-{4-[butyl(3-chloro-4,5-dimethoxybenzyl)amino]phenyl}- 1,1,1,3,3,3-hexafluoropropan-2- ol | A,B,C,D | 3FAL | 0.75 | ![]() |
IMN![]() | INDOMETHACIN | A | 2BXM | 0.72 | ![]() |
IMN![]() | INDOMETHACIN | A | 3FO7 | 0.72 | ![]() |
IMN![]() | INDOMETHACIN | A,B,C,D | 1Z9H | 0.72 | ![]() |
IMN![]() | INDOMETHACIN | A | 2BXQ | 0.72 | ![]() |
IMN![]() | INDOMETHACIN | A,B,C,D | 4COX | 0.72 | ![]() |
IMN![]() | INDOMETHACIN | A | 2ALT | 0.72 | ![]() |
IMN![]() | INDOMETHACIN | A | 2OTH | 0.72 | ![]() |
IMN![]() | INDOMETHACIN | A,B | 2DM6 | 0.72 | ![]() |
IMN![]() | INDOMETHACIN | A | 1S2A | 0.72 | ![]() |
IMN![]() | INDOMETHACIN | A | 2ZB8 | 0.72 | ![]() |
IMN![]() | INDOMETHACIN | A | 3HWZ | 0.72 | ![]() |
IMN![]() | INDOMETHACIN | A | 2BXK | 0.72 | ![]() |
900![]() | N-(4-chlorophenyl)-6-[(6,7-dimethoxyquinolin- 4-yl)oxy]naphthalene-1-carboxamide | A,B | 3B8Q | 0.74 | ![]() |
253![]() | 10,11-dimethoxy-4-methyldibenzo[c,f]- 2,7-naphthyridine-3,6-diamine | A | 2R7B | 0.72 | ![]() |
9HP![]() | 9-(4-HYDROXYPHENYL)-2,7-PHENANTHROLINE | A | 1PMU | 0.73 | ![]() |
PFH![]() | 6,7-DIMETHOXY-4-[(3R)-3-(2-NAPHTHYLOXY)PYRROLIDIN- 1-YL]QUINAZOLINE | A | 2OVV | 0.7 | ![]() |
991![]() | 2-{5-[AMINO(IMINIO)METHYL]-6-CHLORO- 1H-INDOL-2-YL}-6-(CYCLOPENTYLOXY)BENZENOLATE | A | 1O2Q | 0.72 | ![]() |
DEH![]() | 2,9-dihydroxy-3,10-dimethoxy-5,6- dihydroisoquino[3,2-a]isoquinolinium | A | 3GSY | 0.8 | ![]() |
2RL![]() | N-(4-CHLOROPHENYL)-7-[(6,7-DIMETHOXYQUINOLIN- 4-YL)OXY]-2,3-DIHYDRO-1,4-BENZOXAZINE- 4-CARBOXAMIDE | A | 2RL5 | 0.7 | ![]() |
RO0![]() | 1-(3,4-DIMETHOXYBENZYL)-6,7-DIMETHOXY- 4-{[4-(2-METHOXYPHENYL)PIPERIDIN- 1-YL]METHYL}ISOQUINOLINE | A | 2FVJ | 0.75 | ![]() |
DTQ![]() | 4-[3-HYDROXYANILINO]-6,7-DIMETHOXYQUINAZOLINE | A | 1DI8 | 0.71 | ![]() |
QUN![]() | QUINACRINE | A,B | 1JQE | 0.76 | ![]() |
238![]() | A | 2PRH | 0.7 | ![]() | |
QNO![]() | 2-NONYL-4-HYDROXYQUINOLINE N-OXIDE | C,D,E | 1NU1 | 0.72 | ![]() |
QNO![]() | 2-NONYL-4-HYDROXYQUINOLINE N-OXIDE | A,B,C,D,G | 2E75 | 0.72 | ![]() |
HQO![]() | 2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE | A,B,C | 1KQG | 0.72 | ![]() |
HQO![]() | 2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE | A,B,C,D,E,F | 2VR0 | 0.72 | ![]() |
HQO![]() | 2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE | A,B,C,M,N,O,P | 1KF6 | 0.72 | ![]() |
783![]() | 3-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-5-METHOXY-1,1'-BIPHENYL-2- OLATE | A | 1O2T | 0.7 | ![]() |
CQA![]() | 4-[(7-CHLOROQUINOLIN-4-YL)AMINO]- 2-[(DIETHYLAMINO)METHYL]PHENOL | A,B | 2AOU | 0.71 | ![]() |
7PC![]() | 2-[4-(AMINOMETHYL)-2-CHLOROPHENOXY]- 5-PYRIDIN-2-YLPHENOL | A,B | 2OP0 | 0.81 | ![]() |
61E![]() | 4-(2-chlorophenyl)-8-[3-(dimethylamino)propoxy]- 9-hydroxy-6-methylpyrrolo[3,4-c]carbazole- 1,3(2H,6H)-dione | A | 3BIZ | 0.73 | ![]() |
134![]() | 6-FLUORO-2-[2-HYDROXY-3-(2-METHYL- CYCLOHEXYLOXY)-PHENYL]-1H-INDOLE- 5-CARBOXAMIDINE | B | 1GJ9 | 0.73 | ![]() |
BER![]() | BERBERINE | A | 3D6Y | 0.73 | ![]() |
BER![]() | BERBERINE | A,B,D,E | 1JUM | 0.73 | ![]() |
BER![]() | BERBERINE | A,B,D,E | 3BTI | 0.73 | ![]() |
BER![]() | BERBERINE | A | 2QVD | 0.73 | ![]() |