Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02672886
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 |
714![]() | 1-(2,2-diphosphonoethyl)-3-(octyloxy)pyridinium | A,B | 3EFQ | 0.71 | ![]() |
FAL![]() | (2R)-1-[4-({4-[(2,5-DICHLOROPHENYL)AMINO]PYRIMIDIN- 2-YL}AMINO)PHENOXY]-3-(DIMETHYLAMINO)PROPAN- 2-OL | A | 1H01 | 0.7 | ![]() |
77A![]() | 1-(5-CHLORO-2-METHOXYPHENYL)-3- {6-[2-(DIMETHYLAMINO)-1-METHYLETHOXY]PYRAZIN- 2-YL}UREA | A | 2E9P | 0.77 | ![]() |
4PY![]() | (2S)-1-(6H-INDOL-3-YL)-3-{[5-(7H- PYRAZOLO[3,4-C]PYRIDIN-5-YL)PYRIDIN- 3-YL]OXY}PROPAN-2-AMINE | E | 2OJF | 0.71 | ![]() |
3IP![]() | 3-(BENZYLOXY)PYRIDIN-2-AMINE | A | 1W7H | 0.73 | ![]() |
LIB![]() | 3-(2-CHLOROPHENYL)-1-(2-{[(1S)- 2-HYDROXY-1,2-DIMETHYLPROPYL]AMINO}PYRIMIDIN- 4-YL)-1-(4-METHOXYPHENYL)UREA | A | 2GHL | 0.74 | ![]() |
A25![]() | 18-CHLORO-11,12,13,14-TETRAHYDRO- 1H,10H-8,4-(AZENO)-9,15,1,3,6-BENZODIOXATRIAZACYCLOHEPTADECIN- 2-ONE | A | 2E9U | 0.77 | ![]() |
L09![]() | N-(3-TERT-BUTYL-1H-PYRAZOL-5-YL)- N'-{4-CHLORO-3-[(PYRIDIN-3-YLOXY)METHYL]PHENYL}UREA | A | 1WBN | 0.71 | ![]() |
LIC![]() | 3-(2-CHLOROBENZYL)-1-(2-{[(1S)- 2-HYDROXY-1,2-DIMETHYLPROPYL]AMINO}PYRIMIDIN- 4-YL)-1-(4-METHOXYPHENYL)UREA | A | 2GHM | 0.72 | ![]() |
722![]() | 1-(2,2-diphosphonoethyl)-3-(heptyloxy)pyridinium | A,B | 3EGT | 0.71 | ![]() |
245![]() | 1-(2-chloropyridin-4-yl)-3-phenylurea | A | 2QKN | 0.71 | ![]() |
721![]() | 3-butoxy-1-(2,2-diphosphonoethyl)pyridinium | A,B | 3DYH | 0.72 | ![]() |
B71![]() | 3-(DECYLOXY)-1-(2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A,B | 2ZEU | 0.7 | ![]() |
B71![]() | 3-(DECYLOXY)-1-(2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A,B | 2ZEV | 0.7 | ![]() |
A42![]() | 1-(5-CHLORO-2,4-DIMETHOXYPHENYL)- 3-(5-CYANOPYRAZIN-2-YL)UREA | A | 2YWP | 0.72 | ![]() |
L11![]() | N-[4-CHLORO-3-(PYRIDIN-3-YLOXYMETHYL)- PHENYL]-3-FLUORO- | A | 1W83 | 0.78 | ![]() |
85A![]() | 18-CHLORO-2-OXO-17-[(PYRIDIN-4- YLMETHYL)AMINO]-2,3,11,12,13,14- HEXAHYDRO-1H,10H-4,8-(AZENO)-9,15,1,3,6- BENZODIOXATRIAZACYCLOHEPTADECINE- 7-CARBONITRILE | A,B | 2E9V | 0.7 | ![]() |
CLW![]() | CHLORZOXAZONE | A,B | 1M9J | 0.71 | ![]() |
CLW![]() | CHLORZOXAZONE | A,B | 1M8D | 0.71 | ![]() |
FBL![]() | (2S)-1-[4-({4-[(2,5-DICHLOROPHENYL)AMINO]PYRIMIDIN- 2-YL}AMINO)PHENOXY]-3-(DIMETHYLAMINO)PROPAN- 2-OL | A | 1H01 | 0.7 | ![]() |
282![]() | 3-methoxypyridine | X | 2RBZ | 0.78 | ![]() |
9IP![]() | N~3~-[3-(5-METHOXYPYRIDIN-3-YL)BENZYL]PYRIDINE- 2,3-DIAMINE | A | 2OHS | 0.71 | ![]() |
TCD![]() | 3,5-DICHLORO-2-{4-[(3,5-DICHLOROPYRIDIN- 2-YL)OXY]PHENOXY}PYRIDINE | A,B,C,D,E,F, G,H | 1XLS | 0.76 | ![]() |
KIN![]() | 1-[4-(PYRIDIN-4-YLOXY)PHENYL]-3- [3-(TRIFLUOROMETHYL)PHENYL]UREA | A | 2HZN | 0.73 | ![]() |