Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00168217
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 |
39A![]() | 6-AMINO-3,9-DIMETHYL-9H-PURIN-3- IUM | A,B | 1PU7 | 0.72 | ![]() |
PPZ![]() | 2-(PYRIDO[1,2-E]PURIN-4-YL)AMINO- ETHANOL | A,B | 1I5V | 0.73 | ![]() |
IHE![]() | 6-(CYCLOHEXYLAMINO)-9-[2-(4-METHYLPIPERAZIN- 1-YL)-ETHYL]-9H-PURINE-2-CARBONITRILE | A | 1U9V | 0.74 | ![]() |
DX3![]() | 6,7,7-trimethyl-7,8-dihydropteridine- 2,4-diamine | A,B,C,D | 3BMF | 0.7 | ![]() |
ADZ![]() | 9-METHYL-9H-PURIN-6-AMINE | A | 1O9U | 0.72 | ![]() |
BCP![]() | 2-BROMO-6-CHLORO-PURINE | A | 1M66 | 0.7 | ![]() |
BCP![]() | 2-BROMO-6-CHLORO-PURINE | A | 1N1G | 0.7 | ![]() |
6GU![]() | 6-chloroguanine | A | 3FO4 | 0.73 | ![]() |
6GU![]() | 6-chloroguanine | A | 3GOG | 0.73 | ![]() |
6GU![]() | 6-chloroguanine | A | 3GER | 0.73 | ![]() |
CFP![]() | 6-CHLORO-2-FLUOROPURINE | A | 1JDJ | 0.71 | ![]() |
MXD![]() | 6-PIPERIDIN-1-YLPYRIMIDINE-2,4- DIAMINE 3-OXIDE | A,B | 3B6H | 0.73 | ![]() |
M01![]() | 1-[1-(9H-purin-6-yl)piperidin-4- yl]methanamine | A | 2VNW | 0.75 | ![]() |
M02![]() | 1-(9H-purin-6-yl)piperidin-4-amine | A | 2VNY | 0.77 | ![]() |