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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01603333

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
RBE3-(BENZOYLOXY)-8-AZA-BICYCLO[3.2.1]OCTANE-
2-CARBOXYLIC ACID
H1RIU0.71
1TBMETHYL 2-[4-METHOXY-6-METHYL-1,3,5-
TRAZIN-2-YL(METHYL)CARBAMOYLSULFAMOYL]BENZOATE
A,B1T9A0.72
1TBMETHYL 2-[4-METHOXY-6-METHYL-1,3,5-
TRAZIN-2-YL(METHYL)CARBAMOYLSULFAMOYL]BENZOATE
A1YI10.72
FC1THIOCOUMARINA2BHJ0.71
BCG3-(BENZOYLOXY)-8-METHYL-8-AZABICYCLO[3.2.1]OCTANE-
2-CARBOXYLIC ACID
H1QYG0.71
1MMMETHYL 2-[({[(4-METHOXY-6-METHYL-
1,3,5-TRIAZIN-2-YL)AMINO]CARBONYL}AMINO)SULFONYL]BENZOATE
A,B,C,D1T9D0.7
1MMMETHYL 2-[({[(4-METHOXY-6-METHYL-
1,3,5-TRIAZIN-2-YL)AMINO]CARBONYL}AMINO)SULFONYL]BENZOATE
A1YHY0.7
EMT2-(ETHYLMERCURI-THIO)-BENZOIC ACIDA,B1KDG0.7
EMT2-(ETHYLMERCURI-THIO)-BENZOIC ACIDA,B,C,D1O9L0.7
M29ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATEA2NNV0.7
M29ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATEA,B2NN70.7
COCCOCAINEA,C1I7Z0.73
COCCOCAINEH1Q720.73
COCCOCAINEL2AJV0.73
COCCOCAINEA,B,C,D,E2PGZ0.73
LOBLOBELINEA,B,C,D,E,F,
G,H,I,J
2BYS0.7
BZMBENZOIC ACID PHENYLMETHYLESTERA,B1DZM0.71