Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02913342
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 |
H7J![]() | N-[(1S)-1-{1-[(1R,3E)-1-ACETYLPENT- 3-EN-1-YL]-1H-1,2,3-TRIAZOL-4-YL}- 1,2-DIMETHYLPROPYL]BENZAMIDE | A,B,C | 2HXZ | 0.75 | ![]() |
H7J![]() | N-[(1S)-1-{1-[(1R,3E)-1-ACETYLPENT- 3-EN-1-YL]-1H-1,2,3-TRIAZOL-4-YL}- 1,2-DIMETHYLPROPYL]BENZAMIDE | A,B | 2H7J | 0.75 | ![]() |
SU1![]() | 3-[(3-(2-CARBOXYETHYL)-4-METHYLPYRROL- 2-YL)METHYLENE]-2-INDOLINONE | A,B | 1FGI | 0.72 | ![]() |
LZ9![]() | {[(2,6-difluorophenyl)carbonyl]amino}- N-(4-fluorophenyl)-1H-pyrazole- 3-carboxamide | A | 2VTP | 0.71 | ![]() |
DAY![]() | 1-[(1R,2R,3aS,3bS,10aR,10bS,11S,12aS)- 1,11-dihydroxy-2,5,10a,12a-tetramethyl- 7-phenyl-1,2,3,3a,3b,7,10,10a,10b,11,12,12a- dodecahydrocyclopenta[5,6]naphtho[1,2- f]indazol-1-yl]-2-hydroxyethanone | A | 3BQD | 0.72 | ![]() |
ITR![]() | IMINO-TRYPTOPHAN | A,B,C,D,E,F, G,H | 1DDO | 0.72 | ![]() |
RSS![]() | 5-METHYL-3-(9-OXO-1,8-DIAZA-TRICYCLO[10.6.1.013,18]NONADECA- 12(19),13,15,17-TETRAEN-10-YLCARBAMOYL)- HEXANOIC ACID | A,B | 1MMP | 0.72 | ![]() |
TRF![]() | N1-FORMYL-TRYPTOPHAN | A,B | 1VRK | 0.71 | ![]() |
TRF![]() | N1-FORMYL-TRYPTOPHAN | A,B,C,D | 1QS7 | 0.71 | ![]() |
NOW![]() | Nalpha-[(3-tert-butyl-1-methyl- 1H-pyrazol-5-yl)carbonyl]-N-[(2Z)- 2-iminoethyl]-3-methyl-L-phenylalaninamide | A,B,C,D | 3HHA | 0.77 | ![]() |
LZD![]() | 4-{[(2,6-difluorophenyl)carbonyl]amino}- N-[(3S)-piperidin-3-yl]-1H-pyrazole- 3-carboxamide | A | 2VTT | 0.71 | ![]() |
19A![]() | N,N-DIMETHYL-4-(4-PHENYL-1H-PYRAZOL- 3-YL)-1H-PYRROLE-2-CARBOXAMIDE | A | 2OJG | 0.73 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,B,C,D | 2R3C | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1XY8 | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,B,C,H,K,L | 2R5D | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 2V7K | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,D | 1CZQ | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1DFY | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1XY5 | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1NXN | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1TKF | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1YL9 | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1XXZ | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1XY4 | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,D | 2Q3I | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1QFB | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1DFZ | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1XY9 | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1XY6 | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 2SOC | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 2JUE | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1SOC | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1YL8 | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,B,C,D,E,F, G,H | 1DDO | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,B | 2Q33 | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1DG0 | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,B,C,H,K,L | 2R5B | 0.71 | ![]() |
BP5![]() | 3-(2,2'-BIPYRIDIN-5-YL)-L-ALANINE | A | 2PXH | 0.7 | ![]() |
PPX![]() | [PHENYLALANINYL-PROLINYL]-[2-(PYRIDIN- 4-YLAMINO)-ETHYL]-AMINE | E,H | 1QBV | 0.72 | ![]() |
IOP![]() | INDOLYLPROPIONIC ACID | A,B | 1AHF | 0.72 | ![]() |
IOP![]() | INDOLYLPROPIONIC ACID | A | 2OLI | 0.72 | ![]() |
IOP![]() | INDOLYLPROPIONIC ACID | A,B | 2AY5 | 0.72 | ![]() |
4IN![]() | 4-AMINO-L-TRYPTOPHAN | A,B | 2HXX | 0.72 | ![]() |
4IN![]() | 4-AMINO-L-TRYPTOPHAN | A | 1OXF | 0.72 | ![]() |
LZA![]() | {[(2,6-difluorophenyl)carbonyl]amino}- N-piperidin-4-yl-1H-pyrazole-3- carboxamide | A | 2VTQ | 0.71 | ![]() |
1CM![]() | (2R)-2-PHENYL-N-PYRIDIN-4-YLBUTANAMIDE | A | 2CI0 | 0.72 | ![]() |
4PP![]() | C,L | 1XKA | 0.73 | ![]() | |
4PP![]() | A,B,C,D | 1XKB | 0.73 | ![]() |