Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02864249
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 |
NE2 | 3,3',4',5-TETRACHLOROBIPHENYL-4- OL | A,B | 2GAB | 0.77 | |
43M | 4-CHLORO-3-METHYLPHENOL | A | 2P7A | 0.75 | |
BP6 | 2',6'-DICHLORO-BIPHENYL-2,6-DIOL | A | 1LKD | 0.78 | |
BPZ | 4,4'-cyclohexane-1,1-diyldiphenol | A | 2ZKC | 0.72 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.73 | |
2NA | naphthalen-2-ylmethanol | A,B,C | 3EE5 | 0.72 | |
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.72 | |
174 | 4-CHLORO-BENZOIC ACID | X | 3DLP | 0.7 | |
174 | 4-CHLORO-BENZOIC ACID | X | 1T5D | 0.7 | |
THK | 4-(4-CHLORO-PHENYL)-1-{3-[2-(4- FLUORO-PHENYL)-[1,3]DITHIOLAN-2- YL]-PROPYL}-PIPERIDIN-4-OL | B | 1AID | 0.71 | |
THK | 4-(4-CHLORO-PHENYL)-1-{3-[2-(4- FLUORO-PHENYL)-[1,3]DITHIOLAN-2- YL]-PROPYL}-PIPERIDIN-4-OL | A,B | 2AID | 0.71 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 1G3M | 0.77 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 2G5U | 0.77 | |
SS1 | 1-PHENYLETHANOL | H | 1UM5 | 0.74 | |
NDH | (1R, 2S)-CIS 1,2 DIHYDROXY-1,2- DIHYDRONAPHTHALENE | A,B | 1O7P | 0.7 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.75 | |
DES | DIETHYLSTILBESTROL | A,B | 3ERD | 0.75 | |
DES | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.75 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.75 | |
BP3 | 2'-CHLORO-BIPHENYL-2,3-DIOL | A | 1LGT | 0.78 | |
4NA | 1-CHLORO-6-(4-HYDROXYPHENYL)-2- NAPHTHOL | A,B | 1YY4 | 0.72 | |
2CL | (2,6-DICHLOROPHENYL)ACETIC ACID | A | 2IPW | 0.71 | |
2CL | (2,6-DICHLOROPHENYL)ACETIC ACID | A | 2IS7 | 0.71 | |
8PP | 2-[(2E,6E,10E,14E,18E,22E,26E)- 3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA- 2,6,10,14,18,22,26,30-OCTAENYL]PHENOL | A,B,C,D | 1Y0G | 0.71 | |
AFI | 2-[4-(4-CHLOROPHENYL)CYCLOHEXYLIDENE]- 3,4-DIHYDROXY-1(2H)-NAPHTHALENONE | A,B | 1UUM | 0.74 | |
PFL | 2,6-BIS(1-METHYLETHYL)PHENOL | A,B | 1E7A | 0.75 | |
ETC | (R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL | A,B | 1L2I | 0.71 | |
ETC | (R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL | A,B | 1L2J | 0.71 | |
12M | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.74 | |
NE1 | 2',3,3',4',5-PENTACHLOROBIPHENYL- 4-OL | A,B | 2G9K | 0.78 | |
LJ1 | 2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN0 | 0.75 | |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.77 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.74 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.74 | |
1OH | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.74 | |
IPB | 5-METHYL-2-(1-METHYLETHYL)PHENOL | A,B | 1E06 | 0.71 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZK0 | 0.74 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJZ | 0.74 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJY | 0.74 | |
269 | (1R)-3-chloro-1-phenylpropan-1- ol | A | 2RBS | 0.77 |