Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02625980
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 |
5PP | 5-PENTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B36 | 0.71 | |
8PS | 5-OCTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B37 | 0.71 | |
ZZ1 | 4-METHYL-2H-CHROMEN-2-ONE | A | 2CIP | 0.71 | |
OBP | A,B | 2DE3 | 0.7 | ||
294 | N-hydroxy-4-({4-[4-(trifluoromethyl)phenoxy]phenyl}sulfonyl)tetrahydro- 2H-pyran-4-carboxamide | A,B | 3B8Z | 0.73 | |
LZ2 | 5-hydroxynaphthalene-1-sulfonamide | A | 2VTH | 0.71 | |
D32 | (2,3-dimethyl-4-{[2-(prop-2-yn- 1-yloxy)-4-{[4-(trifluoromethyl)phenoxy]methyl}phenyl]sulfanyl}phenoxy)acetic acid | A | 3GZ9 | 0.72 | |
B65 | (1R)-4-(3-phenoxyphenyl)-1-phosphonobutane- 1-sulfonic acid | A | 2ZCQ | 0.76 | |
440 | 3-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}propane- 1-thiol | A | 3B92 | 0.75 | |
MSB | 1-METHYLOXY-4-SULFONE-BENZENE | A | 1EUB | 0.72 | |
MSB | 1-METHYLOXY-4-SULFONE-BENZENE | A | 1BM6 | 0.72 | |
81A | 2-METHANESULFONYL-BENZENESULFONIC ACID 3- METHYL-5-((1-AMIDINOAMINOOXYMETHYL- CYCLOPROPYL)METHYLOXY)-PHENYLESTER | H,I | 1T4U | 0.72 | |
RS2 | N-HYDROXY-2-[4-(4-PHENOXY-BENZENESULFONYL)- TETRAHYDRO-PYRAN-4-YL]-ACETAMIDE | A | 966C | 0.71 | |
178 | 4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)- 2-ISOPROPYLPHENOL | A,B | 1TVE | 0.71 | |
BR3 | (6-METHYL-3,4-DIHYDRO-2H-CHROMEN- 2-YL)METHYLPHOSPHINATE | A | 1PE5 | 0.71 |