Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02242589
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 | 0.82 | |
DRE | N-(6-AMINOHEXYL)HEXANE-1,6-DIAMINE | A,B | 1Z6L | 0.7 | |
DIP | DIPENTYLAMINE | C,D | 1A1B | 0.72 | |
DIP | DIPENTYLAMINE | C,D | 1A07 | 0.72 | |
DIP | DIPENTYLAMINE | C,D | 1A1A | 0.72 | |
DIP | DIPENTYLAMINE | C,D | 1A08 | 0.72 | |
DIP | DIPENTYLAMINE | C,D | 1A09 | 0.72 | |
PPL | PIPERIDINE-2-CARBOXYLIC ACID TERT- BUTYLAMIDE | A,B | 1IDB | 0.72 | |
PPL | PIPERIDINE-2-CARBOXYLIC ACID TERT- BUTYLAMIDE | A,B | 1IDA | 0.72 | |
RIN | 3-AMINO-AZACYCLOTRIDECAN-2-ONE | A,B | 1KBC | 0.76 | |
HPL | HEPTYLFORMAMIDE | A,B | 1U3V | 0.79 | |
SP5 | N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]acetamide | A,B | 3CND | 0.81 | |
NMH | (R)-N-(1-METHYL-HEXYL)-FORMAMIDE | A,B,C,D | 1P1R | 0.75 | |
FXY | 1-METHYLHEPTYLFORMAMIDE | A,B | 1U3W | 0.73 | |
SP7 | N-{(1S)-3-[(4-aminobutyl)amino]- 1-methylpropyl}acetamide | A,B | 3CNP | 0.79 | |
RHS | 3-(CARBOXYAMIDE(2-CARBOXYAMIDE- 2-TERTBUTYLETHYL))PENTAN | A | 1JLD | 0.7 | |
LDM | 3-LAURYLAMIDO-N,N'-DIMETHYLPROPYLAMINOXYDE | A | 1OKC | 0.74 |