Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00708638
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 |
258 | (2-chloroethoxy)benzene | X | 2RAY | 0.74 | |
CTX | (Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)- PHENOXY]-N,N-DIMETHYLETHANAMINE | A,B,C | 1YA4 | 0.71 | |
INK | (RP,SP)-O-(2R)-(1-PHENOXYBUT-2- YL)-METHYLPHOSPHONIC ACID CHLORIDE | A | 1HQD | 0.7 | |
505 | (2R)-1-(2,6-dimethylphenoxy)propan- 2-amine | A | 2VIN | 0.75 | |
MLG | N-[3-(2,4-DICHLOROPHENOXY)PROPYL]- N-METHYL-N-PROP-2-YNYLAMINE | A,B | 2BXR | 0.82 | |
MLG | N-[3-(2,4-DICHLOROPHENOXY)PROPYL]- N-METHYL-N-PROP-2-YNYLAMINE | A,B | 2BXS | 0.82 | |
MLG | N-[3-(2,4-DICHLOROPHENOXY)PROPYL]- N-METHYL-N-PROP-2-YNYLAMINE | A,B,C,D | 1O5W | 0.82 | |
NXN | 2-(2,4-DICHLORO-PHENOXY)-N-(2-MERCAPTO- ETHYL)-ACETAMIDE | A,B | 1SHJ | 0.82 | |
ZHH | 2-(4-METHOXYPHENYL)ETHANAMINE | D,H | 2HKR | 0.71 | |
DCN | DICLOSAN | A,B,C,D | 2PD4 | 0.7 | |
RFX | (3R)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan- 1-amine | A | 3GWV | 0.71 | |
GMN | 2,2',2"-[1,2,3-BENZENE-TRIYLTRIS(OXY)]TRIS[N,N,N- TRIETHYLETHANAMINIUM] | A,B | 1N5M | 0.75 | |
SFX | (3S)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan- 1-amine | A | 3GWW | 0.71 | |
POT | (1S)-1-(PHENOXYMETHYL)PROPYL METHYLPHOSPHONOCHLORIDOATE | A | 2NW6 | 0.7 | |
TAX | (Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)- PHENOXY]-N,N-DIMETHYLETHANAMINIUM | A | 1FJ5 | 0.75 |