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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01873198

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
C2R5-AMINO-1-(5-O-PHOSPHONO-BETA-D-
RIBOFURANOSYL)-1H-IMIDAZOLE-4-CARBOXYLIC ACID
A2NSJ0.72
C2R5-AMINO-1-(5-O-PHOSPHONO-BETA-D-
RIBOFURANOSYL)-1H-IMIDAZOLE-4-CARBOXYLIC ACID
A,B2GQS0.72
C2R5-AMINO-1-(5-O-PHOSPHONO-BETA-D-
RIBOFURANOSYL)-1H-IMIDAZOLE-4-CARBOXYLIC ACID
A2NSL0.72
5AC5-amino-1H-imidazole-4-carboxamideA,B3CL80.73
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A,B,C,D2NYN0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A,B,C,D,E,F,
G,H
2O6Y0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A,B,C,D,E,F,
G,H
2O780.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A,B,C,D,E,F,
G,H
2O7F0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A,B2RJR0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A,B,C,D,E,F,
G,H
2O7E0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A2NYF0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A,B,C,D,E,F,
G,H
2O7B0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A,B2QVE0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A,B,C,D3CZO0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A,B2RJS0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A,B2OHY0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A,B,C,D,E,F,
G,H
2O7D0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID
A,B1W270.72
AGD3-(2-amino-6-oxo-1,6-dihydro-9H-
purin-9-yl)-D-alanine
A,B,C,D3C1P0.76
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B,C,D,E,F,
G,H
1QPY0.74
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B1RRU0.74
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
B1PDT0.74
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B1PUP0.74
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
B1NR80.74
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B1XJ90.74
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A176D0.74
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B,C,D1HZS0.74
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B2K4G0.74
HGL(2S)-2-amino-4-(2-amino-6-oxo-1,6-
dihydro-9H-purin-9-yl)butanoic acid
A,B,C,D3C1P0.73
CFFCAFFEINEA,B1L5Q0.71
CFFCAFFEINEA,B2A3B0.71
CFFCAFFEINEA,B1L7X0.71
CFFCAFFEINEA1GFZ0.71
CFFCAFFEINEA,B3DDW0.71
CFFCAFFEINEA,B3DD10.71
CFFCAFFEINEA,B3DDS0.71
CFFCAFFEINEA1C8L0.71
37TTHEOBROMINEA2EFJ0.72
GU72-AMINO-7-[2-(2-HYDROXY-1-HYDROXYMETHYL-
ETHYLAMINO)-ETHYL]-1,7-DIHYDRO-
PURIN-6-ONE
A1FXU0.71
NDM7,9-DIMETHYLGUANINEA1JSZ0.7