Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02632710
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 |
COX![]() | 4-(5-METHYL-3-PHENYLISOXAZOL-4- YL)BENZENESULFONAMIDE | A | 2AW1 | 0.73 | ![]() |
PXB![]() | parecoxib | A | 2ZMB | 0.76 | ![]() |
BI7![]() | 3-[(3AS,4R,8AS,8BR)-4-[5-(5-CHLORO- 2-THIENYL)ISOXAZOL-3-YL]-1,3-DIOXOOCTAHYDROPYRROLO[3,4- A]PYRROLIZIN-2(3H)-YL]-N,N,N-TRIMETHYLPROPAN- 1-AMINIUM | A | 2JKH | 0.71 | ![]() |
SOY![]() | OXACILLIN-ACYLATED SERINE | A | 2IWD | 0.82 | ![]() |
105![]() | N-[5-METHYL-3-O-TOLYL-ISOXAZOLE- 4-CARBOXYLIC ACID AMIDE] BORONIC ACID | A | 1JWZ | 0.78 | ![]() |
105![]() | N-[5-METHYL-3-O-TOLYL-ISOXAZOLE- 4-CARBOXYLIC ACID AMIDE] BORONIC ACID | A,B | 1FSY | 0.78 | ![]() |
105![]() | N-[5-METHYL-3-O-TOLYL-ISOXAZOLE- 4-CARBOXYLIC ACID AMIDE] BORONIC ACID | A | 1NYY | 0.78 | ![]() |
IIA![]() | 1-{[5-(5-CHLORO-2-THIENYL)ISOXAZOL- 3-YL]METHYL}-N-(1-ISOPROPYLPIPERIDIN- 4-YL)-1H-INDOLE-2-CARBOXAMIDE | A,B | 2BOH | 0.7 | ![]() |
AG7![]() | 4-{2-(4-FLUORO-BENZYL)-6-METHYL- 5-[(5-METHYL-ISOXAZOLE-3-CARBONYL)- AMINO]-4-OXO-HEPTANOYLAMINO}-5- (2-OXO-PYRROLIDIN-3-YL)-PENTANOIC ACID ETHYL ESTER | A | 1CQQ | 0.71 | ![]() |
CXN![]() | CLOXACILLIN | A,B | 1FCM | 0.79 | ![]() |