Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03508782
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 |
ICC | azepan-2-one | A,B | 2ZUK | 0.83 | |
LDM | 3-LAURYLAMIDO-N,N'-DIMETHYLPROPYLAMINOXYDE | A | 1OKC | 0.81 | |
THT | TRANS-2-HEXADECENOYL-(N-ACETYL- CYSTEAMINE)-THIOESTER | A,B,C,D,E,F | 1BVR | 0.71 | |
PPL | PIPERIDINE-2-CARBOXYLIC ACID TERT- BUTYLAMIDE | A,B | 1IDB | 0.73 | |
PPL | PIPERIDINE-2-CARBOXYLIC ACID TERT- BUTYLAMIDE | A,B | 1IDA | 0.73 | |
FXY | 1-METHYLHEPTYLFORMAMIDE | A,B | 1U3W | 0.71 | |
SP7 | N-{(1S)-3-[(4-aminobutyl)amino]- 1-methylpropyl}acetamide | A,B | 3CNP | 0.72 | |
SP5 | N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]acetamide | A,B | 3CND | 0.74 | |
BEQ | N-(CARBOXYMETHYL)-N,N-DIMETHYL- 3-[(1-OXODODECYL)AMINO]-1-PROPANAMINIUM INNER SALT | A,B,C,D | 1YBK | 0.74 | |
HPL | HEPTYLFORMAMIDE | A,B | 1U3V | 0.76 | |
HPN | HEPTANAMIDE | A,B | 1NWW | 0.72 | |
NMH | (R)-N-(1-METHYL-HEXYL)-FORMAMIDE | A,B,C,D | 1P1R | 0.72 | |
140 | N-PALMITOYLGLYCINE | A,B | 1JPZ | 0.75 | |
140 | N-PALMITOYLGLYCINE | A,B | 1ZOA | 0.75 | |
140 | N-PALMITOYLGLYCINE | A,B | 3CBD | 0.75 | |
RIN | 3-AMINO-AZACYCLOTRIDECAN-2-ONE | A,B | 1KBC | 0.84 |