Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02335005
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 |
BFL | A,B | 1Q4G | 0.71 | ||
RSO | R-STYRENE OXIDE | A,B | 1PWZ | 0.73 | |
PPP | 3-PHENYL-1,2-PROPANDIOL | A,B | 1HRN | 0.77 | |
SS1 | 1-PHENYLETHANOL | H | 1UM5 | 0.74 | |
NDH | (1R, 2S)-CIS 1,2 DIHYDROXY-1,2- DIHYDRONAPHTHALENE | A,B | 1O7P | 0.72 | |
BDB | A,B | 1KE3 | 0.7 | ||
2HS | HEXYLPHOSPHONIC ACID (S)-2-METHYL- 3-PHENYLPROPYL ESTER | X | 1YS2 | 0.74 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.71 | |
2HR | HEXYLPHOSPHONIC ACID (R)-2-METHYL- 3-PHENYLPROPYL ESTER | X | 1YS1 | 0.74 | |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.7 | |
OBZ | O-benzylhydroxylamine | A,B | 3DTH | 0.7 | |
OBZ | O-benzylhydroxylamine | A,B | 3DTG | 0.7 | |
12M | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.73 | |
FL2 | FLURBIPROFEN METHYL ESTER | A,B | 1HT5 | 0.71 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1I0D | 0.75 | |
PEL | 2-PHENYL-ETHANOL | D,H | 2I0T | 0.75 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1HZY | 0.75 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1I0B | 0.75 | |
PEL | 2-PHENYL-ETHANOL | A | 1EYW | 0.75 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1JGM | 0.75 | |
IBP | IBUPROFEN | A | 3FKX | 0.71 | |
IBP | IBUPROFEN | A,B | 2BXG | 0.71 | |
IBP | IBUPROFEN | A,B | 1EQG | 0.71 | |
IBP | IBUPROFEN | A,B,C | 2WD9 | 0.71 | |
IBP | IBUPROFEN | A | 2PWS | 0.71 | |
4FA | 4-FLUOROPHENETHYL ALCOHOL | A | 1OWZ | 0.73 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZK0 | 0.74 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJZ | 0.74 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJY | 0.74 | |
256 | PHENYL(SULFO)ACETIC ACID | A | 1O4Q | 0.7 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K5S | 0.71 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1KEC | 0.71 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K7D | 0.71 | |
B70 | tripotassium (1R)-4-biphenyl-4- yl-1-phosphonatobutane-1-sulfonate | A | 2ZCS | 0.71 | |
B69 | A | 2ZCR | 0.72 | ||
BPS | A,B | 2DE4 | 0.7 |