Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02422096
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 |
PPL | PIPERIDINE-2-CARBOXYLIC ACID TERT- BUTYLAMIDE | A,B | 1IDB | 0.75 | |
PPL | PIPERIDINE-2-CARBOXYLIC ACID TERT- BUTYLAMIDE | A,B | 1IDA | 0.75 | |
BEQ | N-(CARBOXYMETHYL)-N,N-DIMETHYL- 3-[(1-OXODODECYL)AMINO]-1-PROPANAMINIUM INNER SALT | A,B,C,D | 1YBK | 0.71 | |
1AD | (1S)-2-[(2S,5R)-2-(AMINOMETHYL)- 5-PROP-1-YN-1-YLPYRROLIDIN-1-YL]- 1-CYCLOPENTYL-2-OXOETHANAMINE | A | 2GBG | 0.72 | |
DSD | 7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACID | A | 1DAG | 0.7 | |
DSD | 7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACID | A | 1DAF | 0.7 | |
DSD | 7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACID | A,B,C,D | 3FMF | 0.7 | |
DSD | 7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACID | A | 1DAI | 0.7 | |
BUJ | (3R)-3-(hexadecanoylamino)-4-(trimethylammonio)butanoate | A,B | 2RCU | 0.77 | |
OHM | 3-OXO-N-[(3S)-2-OXOPYRROLIDIN-3- YL]DODECANAMIDE | B,H | 2NTF | 0.74 | |
277 | N-(TRANS-4-{(1S,2S)-2-AMINO-3-[(3S)- 3-FLUOROPYRROLIDIN-1-YL]-1-METHYL- 3-OXOPROPYL}CYCLOHEXYL)-N-METHYLACETAMIDE | A,B | 2OPH | 0.7 | |
LDM | 3-LAURYLAMIDO-N,N'-DIMETHYLPROPYLAMINOXYDE | A | 1OKC | 0.77 | |
GIO | CYCLO-(GLYCINE-L-PROLINE) INHIBITOR | A,B | 1W1P | 0.71 | |
RIN | 3-AMINO-AZACYCLOTRIDECAN-2-ONE | A,B | 1KBC | 0.89 |