Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01070592
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 |
W56 | 5-(5-(4-(5-HYDRO-4-METHYL-2-OXAZOLYL)PHENOXY)PENTYL)- 3-METHYL ISOXAZOLE | 1 | 2RS5 | 0.8 |  |
W71 | 5-(7-(4-(4,5-DIHYDRO-2-OXAZOLYL)PHENOXY)HEPTYL)- 3-METHYL ISOXAZOLE | 1,4 | 1PIV | 0.8 | |
| W71 | 5-(7-(4-(4,5-DIHYDRO-2-OXAZOLYL)PHENOXY)HEPTYL)- 3-METHYL ISOXAZOLE | 1,4 | 1D4M | 0.8 | |
| W71 | 5-(7-(4-(4,5-DIHYDRO-2-OXAZOLYL)PHENOXY)HEPTYL)- 3-METHYL ISOXAZOLE | 1 | 2R04 | 0.8 | |
W59 | 5-(7-(5-HYDRO-4-ETHYL-2-OXAZOLYL)PHENOXY)HEPTYL)- 3-METHYL ISOXAZOLE | 1 | 2RS3 | 0.8 | |
W35 | 5-(5-(4-(4,5-DIHYDRO-2-OXAZOLY)PHENOXY)PENTYL)- 3-METHYL ISOXAZOLE | 1 | 1RUE | 0.79 | |
| W35 | 5-(5-(4-(4,5-DIHYDRO-2-OXAZOLY)PHENOXY)PENTYL)- 3-METHYL ISOXAZOLE | 1 | 2R06 | 0.79 | |
| W35 | 5-(5-(4-(4,5-DIHYDRO-2-OXAZOLY)PHENOXY)PENTYL)- 3-METHYL ISOXAZOLE | 1 | 1RUC | 0.79 | |
| W35 | 5-(5-(4-(4,5-DIHYDRO-2-OXAZOLY)PHENOXY)PENTYL)- 3-METHYL ISOXAZOLE | 1 | 1RUG | 0.79 | |
W91 | 5-(3-(2,6-DICHLORO-4-(4,5-DIHYDRO- 2-OXAZOLYL)PHENOXY)PROPYL)-3-METHYL ISOXAZOLE | 1 | 2HWB | 0.7 | |
| W91 | 5-(3-(2,6-DICHLORO-4-(4,5-DIHYDRO- 2-OXAZOLYL)PHENOXY)PROPYL)-3-METHYL ISOXAZOLE | 1 | 2HWD | 0.7 | |
W43 | 5-(7-(6-CHLORO-4-(5-HYDRO-4-METHYL- 2-OXAZOLYL)PHENOXY)HEPTYL)-3-METHYL ISOXAZOLE | 1 | 2RM2 | 0.75 | |
COX | 4-(5-METHYL-3-PHENYLISOXAZOL-4- YL)BENZENESULFONAMIDE | A | 2AW1 | 0.77 | |
W84 | 5-(7-(5-HYDRO-4-METHYL-2-OXAZOLYL)PHENOXY)HEPTYL)- 3-METHYL ISOXAZOLE | 1 | 2RS1 | 0.8 | |
| W84 | 5-(7-(5-HYDRO-4-METHYL-2-OXAZOLYL)PHENOXY)HEPTYL)- 3-METHYL ISOXAZOLE | 1 | 1RUD | 0.8 | |
| W84 | 5-(7-(5-HYDRO-4-METHYL-2-OXAZOLYL)PHENOXY)HEPTYL)- 3-METHYL ISOXAZOLE | 1 | 1RUI | 0.8 | |
| W84 | 5-(7-(5-HYDRO-4-METHYL-2-OXAZOLYL)PHENOXY)HEPTYL)- 3-METHYL ISOXAZOLE | 1 | 1RUH | 0.8 | |
W33 | 5-(5-(6-CHLORO-4-(4,5-DIHYDRO-2- OXAZOLYL)PHENOXY)PENTYL)-3-METHYL ISOXAZOLE | 1 | 2R07 | 0.74 | |
PXB | parecoxib | A | 2ZMB | 0.78 | |
KGY | 4-({[4-(BUT-2-YN-1-YLOXY)PHENYL]SULFONYL}METHYL)- 1-[(3,5-DIMETHYLISOXAZOL-4-YL)SULFONYL]- N-HYDROXYPIPERIDINE-4-CARBOXAMIDE | A,B,C,D | 2I47 | 0.72 | |
W8R | 5-(7-(5-HYDRO-4-METHYL-2-OXAZOLYL)PHENOXY)HEPTYL)- 3-METHYL ISOXAZOLE | 1 | 2RR1 | 0.8 | |
W54 | 5-(5-(2,6-DICHLORO-4-(4,5-DIHYDRO- 2-OXAZOLY)PHENOXY)PENTYL)-3-METHYL ISOXAZOLE | 1 | 2HWC | 0.72 | |
| W54 | 5-(5-(2,6-DICHLORO-4-(4,5-DIHYDRO- 2-OXAZOLY)PHENOXY)PENTYL)-3-METHYL ISOXAZOLE | 1 | 2HWE | 0.72 | |