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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00257610

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2031,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-
4(3H)-ONE 2,2-DIOXIDE
A,B2IU30.71
2031,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-
4(3H)-ONE 2,2-DIOXIDE
A,B2IU00.71
2EGA,B,C3EPG0.7
2EGA,B2HMD0.7
2EGA,B2HMR0.7
2EGA,B,C3EPI0.7
AGD3-(2-amino-6-oxo-1,6-dihydro-9H-
purin-9-yl)-D-alanine
A,B,C,D3C1P0.76
E1XPHOSPHORIC ACID MONO-[5-(1-ETHYL-
2,6-DIOXO-1,2,3,6-TETRAHYDRO-PURIN-
9-YL)-3-HYDROXY-TETRAHYDRO-FURAN-
2-YLMETHYL]ESTER
C,E1T390.75
63H(6R)-3-(2-deoxy-5-O-phosphono-beta-
D-erythro-pentofuranosyl)-6-hydroxy-
5,6,7,8-tetrahydropyrimido[1,2-
a]purin-10(3H)-one
A2KDA0.7
2DI9-[(2R,5R)-5-(HYDROXYMETHYL)TETRAHYDROFURAN-
2-YL]-1,9-DIHYDRO-6H-PURIN-6-ONE
E1V3Q0.71
CFFCAFFEINEA,B1L5Q0.79
CFFCAFFEINEA,B2A3B0.79
CFFCAFFEINEA,B1L7X0.79
CFFCAFFEINEA1GFZ0.79
CFFCAFFEINEA,B3DDW0.79
CFFCAFFEINEA,B3DD10.79
CFFCAFFEINEA,B3DDS0.79
CFFCAFFEINEA1C8L0.79
D1H1,1'-ETHANE-1,2-DIYLBIS(3,7-DIMETHYL-
3,7-DIHYDRO-1H-PURINE-2,6-DIONE)
A,B2IUZ0.82
01G12R750.72
2098-AMINO-1,3-DIMETHYL-3,7-DIHYDROPURINE-
2,6-DIONE
A1RS20.79
GA29-(1,3-DIHYDROXY-PROPOXYMETHANE)GUANINEA,B1KI20.75
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B,C,D,E,F,
G,H
1QPY0.75
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1RRU0.75
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
B1PDT0.75
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1PUP0.75
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
B1NR80.75
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1XJ90.75
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A176D0.75
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B,C,D1HZS0.75
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B2K4G0.75
37TTHEOBROMINEA2EFJ0.81
2ND2'-DEOXYINOSINEA1Z390.71
AC29-HYROXYETHOXYMETHYLGUANINEA,B2KI50.77
AC29-HYROXYETHOXYMETHYLGUANINEE1PWY0.77
35GGUANOSINE-3',5'-MONOPHOSPHATEA,B3DBA0.7
35GGUANOSINE-3',5'-MONOPHOSPHATEA,B2OUU0.7
35GGUANOSINE-3',5'-MONOPHOSPHATEA,B,C,D,E,F1BHN0.7
35GGUANOSINE-3',5'-MONOPHOSPHATEA2K310.7
3DG9-(3-DEOXY-BETA-D-RIBOFURANOSYL)GUANINEE1V450.72
6HG1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(GUANIN-9-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL
A481D0.71
6HG1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(GUANIN-9-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL
A,B,C,D,E,G2BJ60.71
6HG1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(GUANIN-9-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL
B1EJZ0.71
6HG1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(GUANIN-9-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL
A,B1EC40.71
6HG1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(GUANIN-9-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL
A1D7Z0.71
13A7-(3,4-DIHYDROXY-5R-HYDROXYMETHYLTETRAHYDROFURAN-
2-YL)-2,2-DIOXO-1,2R,3R,7-TETRAHYDRO-
2L6-IMIDAZO[4,5-C][1,2,6]THIADIAZIN-
4S-ONE
A,B,C,D2B1G0.72
63G(6S)-3-(2-deoxy-5-O-phosphono-beta-
D-erythro-pentofuranosyl)-6-hydroxy-
5,6,7,8-tetrahydropyrimido[1,2-
a]purin-10(3H)-one
A2KD90.7