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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03524424

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4BR2-(4-METHYLPHENOXY)ETHYLPHOSPHINATEA1PE70.91
5PP5-PENTYL-2-PHENOXYPHENOLA,B,C,D,E,F2B360.76
8PS5-OCTYL-2-PHENOXYPHENOLA,B,C,D,E,F2B370.76
CMZ(2S)-1-(2,5-dimethylphenoxy)-3-
morpholin-4-ylpropan-2-ol
A2OF00.73
B65(1R)-4-(3-phenoxyphenyl)-1-phosphonobutane-
1-sulfonic acid
A2ZCQ0.77
2MP3,4-DIMETHYLPHENOLA1L5O0.7
258(2-chloroethoxy)benzeneX2RAY0.75
8CM8-HYDROXYCOUMARINA2H8Z0.71
505(2R)-1-(2,6-dimethylphenoxy)propan-
2-amine
A2VIN0.73
BPM4-PHOSPHONOOXY-PHENYL-METHYL-[4-
PHOSPHONOOXY]BENZEN
A1AAX0.74
4HC4-HYDROXY-2H-CHROMEN-2-ONEA,B1V5Y0.7
2C2(2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACIDA2IME0.73
2C2(2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACIDA2IMD0.73
B76A,B2E9D0.82
2682-phenoxyethanolA2RBR0.79
COUCOUMARINA3CRB0.73
COUCOUMARINA2PMJ0.73
COUCOUMARINA2H900.73
COUCOUMARINA,B,C,D1Z100.73
COUCOUMARINA2PWB0.73
2612-ethoxyphenolX2RB10.76
AI73-(heptyloxy)benzoic acidA,B2O3Z0.73
BR3(6-METHYL-3,4-DIHYDRO-2H-CHROMEN-
2-YL)METHYLPHOSPHINATE
A1PE50.83
3002-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATEA1O410.77
4FE(2E)-3-(3-hydroxy-4-methoxyphenyl)prop-
2-enoic acid
A3CBG0.75