Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00036177
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 |
HU1![]() | TERT-BUTYL {(1S)-2-[(1R,2S,5S)- 2-({[(1S)-3-AMINO-1-(CYCLOBUTYLMETHYL)- 2,3-DIOXOPROPYL]AMINO}CARBONYL)- 6,6-DIMETHYL-3-AZABICYCLO[3.1.0]HEX- 3-YL]-1-CYCLOHEXYL-2-OXOETHYL}CARBAMATE | A,C | 2OC0 | 0.73 | ![]() |
HU5![]() | (1R,2S,5S)-N-[(1S)-3-AMINO-1-(CYCLOBUTYLMETHYL)- 2,3-DIOXOPROPYL]-3-[(2S)-2-{[(TERT- BUTYLAMINO)CARBONYL]AMINO}-3,3- DIMETHYLBUTANOYL]-6,6-DIMETHYL- 3-AZABICYCLO[3.1.0]HEXANE-2-CARBOXAMIDE | A,C | 2OC8 | 0.73 | ![]() |
RO4![]() | [[1-[N-HYDROXY-ACETAMIDYL]-3-METHYL- BUTYL]-CARBONYL-LEUCINYL]-ALANINE ETHYL ESTER | A | 2TCL | 0.74 | ![]() |
U17![]() | METHYL N-[(2S,3R)-3-AMINO-2-HYDROXYHEPTANOYL]- L-SERYL-L-LEUCINATE | A | 2GGB | 0.72 | ![]() |
IGN![]() | {[(1R)-2-((2S)-2-{[(3-{[AMINO(IMINO)METHYL]AMINO}PROPYL)AMINO]CARBONYL}PIPERIDINYL)- 1-(CYCLOHEXYLMETHYL)-2-OXOETHYL]AMINO}ACETIC ACID | A | 1K1O | 0.84 | ![]() |
IGN![]() | {[(1R)-2-((2S)-2-{[(3-{[AMINO(IMINO)METHYL]AMINO}PROPYL)AMINO]CARBONYL}PIPERIDINYL)- 1-(CYCLOHEXYLMETHYL)-2-OXOETHYL]AMINO}ACETIC ACID | H,I | 1K21 | 0.84 | ![]() |
Y11![]() | N-[(1S)-2-[(4-cyano-1-methylpiperidin- 4-yl)amino]-1-(cyclohexylmethyl)- 2-oxoethyl]morpholine-4-carboxamide | A,B | 2R9M | 0.83 | ![]() |
169![]() | 1-(4-TERT-BUTYLCARBAMOYL-PIPERAZINE- 1-CARBONYL)-3-(3-GUANIDINO-PROPYL)- 4-OXO-AZETIDINE-2-CARBOXYLIC ACID | A | 1RXP | 0.74 | ![]() |
HUD![]() | TERT-BUTYL [(1S)-1-{[(1R,2S,5S)- 2-({[(1S)-3-AMINO-1-(CYCLOPROPYLMETHYL)- 2,3-DIOXOPROPYL]AMINO}CARBONYL)- 6,6-DIMETHYL-3-AZABICYCLO[3.1.0]HEX- 3-YL]CARBONYL}-2,2-DIMETHYLPROPYL]CARBAMATE | A,C | 2OBO | 0.72 | ![]() |