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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02656960

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
D1H1,1'-ETHANE-1,2-DIYLBIS(3,7-DIMETHYL-
3,7-DIHYDRO-1H-PURINE-2,6-DIONE)
A,B2IUZ0.76
37TTHEOBROMINEA2EFJ0.73
PMMPTERIN-6-YL-METHYL-MONOPHOSPHATEA1EYE0.74
PMMPTERIN-6-YL-METHYL-MONOPHOSPHATEA2BMB0.74
PMMPTERIN-6-YL-METHYL-MONOPHOSPHATEA2VEG0.74
PMMPTERIN-6-YL-METHYL-MONOPHOSPHATEA,B1TWZ0.74
HH26-HYDROXYMETHYLPTERIN-DIPHOSPHATEA,B1AD40.72
HH26-HYDROXYMETHYLPTERIN-DIPHOSPHATEA1RAO0.72
HH26-HYDROXYMETHYLPTERIN-DIPHOSPHATEA,B2DZB0.72
HH26-HYDROXYMETHYLPTERIN-DIPHOSPHATEA,B1TWW0.72
HH26-HYDROXYMETHYLPTERIN-DIPHOSPHATEA1RB00.72
HHS6-CARBOXYPTERINA3H4A0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DY80.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2HD10.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYN0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYS0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2YY20.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3ECN0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYL0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B,C,D1ZKN0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2R8Q0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B,C,D,E,F,
G,H,I,J,K,L
1SOJ0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYQ0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA1RKP0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA1ZKL0.73
HHR6-HYDROXYMETHYLPTERINA3H4A0.74
HHR6-HYDROXYMETHYLPTERINA,B1TMM0.74
HHR6-HYDROXYMETHYLPTERINA1RU20.74
HHR6-HYDROXYMETHYLPTERINA,B,C,D,E,F,
G,H
2W540.74
CFFCAFFEINEA,B1L5Q0.75
CFFCAFFEINEA,B2A3B0.75
CFFCAFFEINEA,B1L7X0.75
CFFCAFFEINEA1GFZ0.75
CFFCAFFEINEA,B3DDW0.75
CFFCAFFEINEA,B3DD10.75
CFFCAFFEINEA,B3DDS0.75
CFFCAFFEINEA1C8L0.75
LUZpteridine-2,4(1H,3H)-dioneA,B,C,L,M,N3ETR0.91
TEPTHEOPHYLLINEA1EHT0.71
TEPTHEOPHYLLINEA,B2A3A0.71
TEPTHEOPHYLLINEA1O150.71
PNX3,7-DIMETHYL-1-(5-OXOHEXYL)-3,7-
DIHYDRO-1H-PURINE-2,6-DIONE
A,B2A3C0.72