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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00047126

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TBP2,4,6-TRIBROMOPHENOLL1E5A0.82
DHR(2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILEA,B1E550.73
LJ33,5-dibromobiphenyl-4-olA,B3CN20.8
LYL2-ALLYL-6-METHYL-PHENOLA1OV70.72
PCRP-CRESOLA1JHV0.71
PCRP-CRESOLA1JHU0.71
PCRP-CRESOLA,B,C,D1DIQ0.71
LJ22,6-dibromo-4-[(E)-2-phenylethenyl]phenolA,B3CN10.83
2LP2-ALLYLPHENOLA1OV50.73
PBRPENTABROMOPHENOLA,B1E4H0.72
BRBPARA-BROMOBENZYL ALCOHOLA,B1HLD0.73
DBY3,5 DIBROMOTYROSINEC,D1EBA0.7
BML4-BROMOPHENOLA,B,E3DHH0.77
BML4-BROMOPHENOLA,B1XU30.77
BML4-BROMOPHENOLA,B1T0S0.77
2BR2-BROMOPHENOLA,B,C,D2A9W0.77
CRSM-CRESOLA,B,C,D1EV30.71
CRSM-CRESOLA,B,C,D,E,F2OMG0.71
CRSM-CRESOLA,B1UZ90.71
CRSM-CRESOLA,B,C,D1ZEH0.71
CRSM-CRESOLA,B,C,D,E,F1ZEI0.71
CRSM-CRESOLA,C,D,E7INS0.71
CRSM-CRESOLA,B,C,D,E,G,
I,K
1EV60.71