Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02098643
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 |
SP5 | N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]acetamide | A,B | 3CND | 0.7 |  |
BB1 | 2-[(FORMYL-HYDROXY-AMINO)-METHYL]- HEXANOIC ACID (1-DIMETHYLCARBAMOYL- 2,2-DIMETHYL-PROPYL)-AMIDE | A,B,C | 1G27 | 0.73 | |
BUM | 2-AMINO-N,3,3-TRIMETHYLBUTANAMIDE | A,B | 1GKC | 0.9 | |
| BUM | 2-AMINO-N,3,3-TRIMETHYLBUTANAMIDE | A,B | 1GKD | 0.9 | |
MNV | N-METHYL-C-AMINO VALINE | C | 1CWJ | 0.82 | |
AIO | [(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN- 2-YL]BORONIC ACID | A | 2EEP | 0.78 | |
| AIO | [(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN- 2-YL]BORONIC ACID | A | 2Z3Z | 0.78 | |
BPR | (2R)-N-[(2R)-2-(DIHYDROXYBORYL)- 1-L-PROLYLPYRROLIDIN-2-YL]-N-[(5R)- 5-(DIHYDROXYBORYL)-1-L-PROLYLPYRROLIDIN- 2-YL]-L-PROLINAMIDE | A,B,C,D | 2AJD | 0.72 | |
PPL | PIPERIDINE-2-CARBOXYLIC ACID TERT- BUTYLAMIDE | A,B | 1IDB | 0.75 | |
| PPL | PIPERIDINE-2-CARBOXYLIC ACID TERT- BUTYLAMIDE | A,B | 1IDA | 0.75 | |
A3M | 2-AMINO-3-METHYL-1-PYRROLIDIN-1- YL-BUTAN-1-ONE | A,B | 1N1M | 0.81 | |
CIB | 2-ACETYLAMINO-4-METHYL-PENTANOIC ACID [1- (1-FORMYL-PENTYLCARBAMOYL)-3-METHYL- BUTYL]-AMIDE | H,I,J,K,L,M,N | 1J2Q | 0.74 | |
BAA | (TERT-BUTYLOXYCARBONYL)-ALANYL- ALANYL-AMINE | A | 1ELG | 0.75 | |
BUG | TERT-LEUCYL AMINE | D | 1D6E | 0.75 | |
INN | 3,N(D,L-[2-(HYDROXYAMINO-CARBONYL)METHYL]- 4-METHYL PENTANOYL)L-3-(TERT-BUTYL)GLYCYL- L-ALANINE | A,B | 3EDZ | 0.73 | |
| INN | 3,N(D,L-[2-(HYDROXYAMINO-CARBONYL)METHYL]- 4-METHYL PENTANOYL)L-3-(TERT-BUTYL)GLYCYL- L-ALANINE | A,B | 3EWJ | 0.73 | |
| INN | 3,N(D,L-[2-(HYDROXYAMINO-CARBONYL)METHYL]- 4-METHYL PENTANOYL)L-3-(TERT-BUTYL)GLYCYL- L-ALANINE | A,B | 2DDF | 0.73 | |
| INN | 3,N(D,L-[2-(HYDROXYAMINO-CARBONYL)METHYL]- 4-METHYL PENTANOYL)L-3-(TERT-BUTYL)GLYCYL- L-ALANINE | A,B,C,D | 2I47 | 0.73 | |
| INN | 3,N(D,L-[2-(HYDROXYAMINO-CARBONYL)METHYL]- 4-METHYL PENTANOYL)L-3-(TERT-BUTYL)GLYCYL- L-ALANINE | A,C,E,I | 1BKC | 0.73 | |
| INN | 3,N(D,L-[2-(HYDROXYAMINO-CARBONYL)METHYL]- 4-METHYL PENTANOYL)L-3-(TERT-BUTYL)GLYCYL- L-ALANINE | A,B | 2FV9 | 0.73 | |
| INN | 3,N(D,L-[2-(HYDROXYAMINO-CARBONYL)METHYL]- 4-METHYL PENTANOYL)L-3-(TERT-BUTYL)GLYCYL- L-ALANINE | A,B | 3E8R | 0.73 | |
SSM | (2S)-2-(acetylamino)-N-methyl-4- [(S)-methylsulfinyl]butanamide | A | 3BQF | 0.75 | |
RHS | 3-(CARBOXYAMIDE(2-CARBOXYAMIDE- 2-TERTBUTYLETHYL))PENTAN | A | 1JLD | 0.77 | |
SP7 | N-{(1S)-3-[(4-aminobutyl)amino]- 1-methylpropyl}acetamide | A,B | 3CNP | 0.76 | |
RIN | 3-AMINO-AZACYCLOTRIDECAN-2-ONE | A,B | 1KBC | 0.73 | |