Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02215819
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 |
LIC![]() | 3-(2-CHLOROBENZYL)-1-(2-{[(1S)- 2-HYDROXY-1,2-DIMETHYLPROPYL]AMINO}PYRIMIDIN- 4-YL)-1-(4-METHOXYPHENYL)UREA | A | 2GHM | 0.73 | ![]() |
LIB![]() | 3-(2-CHLOROPHENYL)-1-(2-{[(1S)- 2-HYDROXY-1,2-DIMETHYLPROPYL]AMINO}PYRIMIDIN- 4-YL)-1-(4-METHOXYPHENYL)UREA | A | 2GHL | 0.75 | ![]() |
A42![]() | 1-(5-CHLORO-2,4-DIMETHOXYPHENYL)- 3-(5-CYANOPYRAZIN-2-YL)UREA | A | 2YWP | 0.76 | ![]() |
FAL![]() | (2R)-1-[4-({4-[(2,5-DICHLOROPHENYL)AMINO]PYRIMIDIN- 2-YL}AMINO)PHENOXY]-3-(DIMETHYLAMINO)PROPAN- 2-OL | A | 1H01 | 0.72 | ![]() |
3IP![]() | 3-(BENZYLOXY)PYRIDIN-2-AMINE | A | 1W7H | 0.72 | ![]() |
CLW![]() | CHLORZOXAZONE | A,B | 1M9J | 0.74 | ![]() |
CLW![]() | CHLORZOXAZONE | A,B | 1M8D | 0.74 | ![]() |
TCD![]() | 3,5-DICHLORO-2-{4-[(3,5-DICHLOROPYRIDIN- 2-YL)OXY]PHENOXY}PYRIDINE | A,B,C,D,E,F, G,H | 1XLS | 0.77 | ![]() |
353![]() | N-{4-[(2-amino-3-chloropyridin- 4-yl)oxy]-3-fluorophenyl}-4-ethoxy- 1-(4-fluorophenyl)-2-oxo-1,2-dihydropyridine- 3-carboxamide | A | 3F82 | 0.7 | ![]() |
7X7![]() | N'-(5-CHLORO-1,3-BENZODIOXOL-4- YL)-N-(3-MORPHOLIN-4-YLPHENYL)PYRIMIDINE- 2,4-DIAMINE | A | 2VX0 | 0.71 | ![]() |
722![]() | 1-(2,2-diphosphonoethyl)-3-(heptyloxy)pyridinium | A,B | 3EGT | 0.71 | ![]() |
714![]() | 1-(2,2-diphosphonoethyl)-3-(octyloxy)pyridinium | A,B | 3EFQ | 0.7 | ![]() |
QUN![]() | QUINACRINE | A,B | 1JQE | 0.71 | ![]() |
FBL![]() | (2S)-1-[4-({4-[(2,5-DICHLOROPHENYL)AMINO]PYRIMIDIN- 2-YL}AMINO)PHENOXY]-3-(DIMETHYLAMINO)PROPAN- 2-OL | A | 1H01 | 0.72 | ![]() |
282![]() | 3-methoxypyridine | X | 2RBZ | 0.75 | ![]() |
PIX![]() | 4-(3-{[5-(trifluoromethyl)pyridin- 2-yl]oxy}benzyl)piperidine-1-carboxylic acid | A,B | 2WAP | 0.71 | ![]() |
FTC![]() | N-[[3-FLUORO-4-ETHOXY-PYRID-2-YL]ETHYL]- N'-[5-CHLORO-PYRIDYL]-THIOUREA | A | 1DTT | 0.71 | ![]() |
FTC![]() | N-[[3-FLUORO-4-ETHOXY-PYRID-2-YL]ETHYL]- N'-[5-CHLORO-PYRIDYL]-THIOUREA | A | 1JLC | 0.71 | ![]() |
7X2![]() | A | 2VWW | 0.71 | ![]() | |
KIN![]() | 1-[4-(PYRIDIN-4-YLOXY)PHENYL]-3- [3-(TRIFLUOROMETHYL)PHENYL]UREA | A | 2HZN | 0.72 | ![]() |
7X6![]() | N-[3-[[4-[(5-CHLORO-1,3-BENZODIOXOL- 4-YL)AMINO]PYRIMIDIN-2-YL]AMINO]PHENYL]METHANESULFONAMIDE | A | 2VWZ | 0.71 | ![]() |
A25![]() | 18-CHLORO-11,12,13,14-TETRAHYDRO- 1H,10H-8,4-(AZENO)-9,15,1,3,6-BENZODIOXATRIAZACYCLOHEPTADECIN- 2-ONE | A | 2E9U | 0.79 | ![]() |
H1L![]() | (2S)-2-(4-{[3-CHLORO-5-(TRIFLUOROMETHYL)PYRIDIN- 2-YL]OXY}PHENOXY)PROPANOIC ACID | A,B,C | 1UYS | 0.72 | ![]() |
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 | 0.73 | ![]() |
L11![]() | N-[4-CHLORO-3-(PYRIDIN-3-YLOXYMETHYL)- PHENYL]-3-FLUORO- | A | 1W83 | 0.75 | ![]() |
9IP![]() | N~3~-[3-(5-METHOXYPYRIDIN-3-YL)BENZYL]PYRIDINE- 2,3-DIAMINE | A | 2OHS | 0.71 | ![]() |
77A![]() | 1-(5-CHLORO-2-METHOXYPHENYL)-3- {6-[2-(DIMETHYLAMINO)-1-METHYLETHOXY]PYRAZIN- 2-YL}UREA | A | 2E9P | 0.8 | ![]() |
896![]() | N-ETHYL-N-ISOPROPYL-3-METHYL-5- {[(2S)-2-(PYRIDIN-4-YLAMINO)PROPYL]OXY}BENZAMIDE | B,H | 2UUJ | 0.71 | ![]() |