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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00705133

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2098-AMINO-1,3-DIMETHYL-3,7-DIHYDROPURINE-
2,6-DIONE
A1RS20.77
HGL(2S)-2-amino-4-(2-amino-6-oxo-1,6-
dihydro-9H-purin-9-yl)butanoic acid
A,B,C,D3C1P0.7
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,E1T390.73
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B,C,D,E,F,
G,H
1QPY0.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B1RRU0.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
B1PDT0.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B1PUP0.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
B1NR80.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B1XJ90.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A176D0.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B,C,D1HZS0.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B2K4G0.78
01G12R750.71
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,D2B1G0.71
AC29-HYROXYETHOXYMETHYLGUANINEA,B2KI50.71
AC29-HYROXYETHOXYMETHYLGUANINEE1PWY0.71
H338-CHLORO-1,3-DIMETHYL-3,7-DIHYDRO-
1H-PURINE-2,6-DIONE
A2UY30.75
D1H1,1'-ETHANE-1,2-DIYLBIS(3,7-DIMETHYL-
3,7-DIHYDRO-1H-PURINE-2,6-DIONE)
A,B2IUZ0.82
GA29-(1,3-DIHYDROXY-PROPOXYMETHANE)GUANINEA,B1KI20.73
AGD3-(2-amino-6-oxo-1,6-dihydro-9H-
purin-9-yl)-D-alanine
A,B,C,D3C1P0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DY80.79
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2HD10.79
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYN0.79
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYS0.79
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2YY20.79
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3ECN0.79
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYL0.79
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B,C,D1ZKN0.79
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2R8Q0.79
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B,C,D,E,F,
G,H,I,J,K,L
1SOJ0.79
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYQ0.79
IBM3-ISOBUTYL-1-METHYLXANTHINEA1RKP0.79
IBM3-ISOBUTYL-1-METHYLXANTHINEA1ZKL0.79
MG77-METHYLGUANOSINEA1EQA0.71
MG77-METHYLGUANOSINEA4DCG0.71
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B,C,D,E,F,
G,H
1QPY0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1RRU0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
B1PDT0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1PUP0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
B1NR80.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1XJ90.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A176D0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B,C,D1HZS0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B2K4G0.72
G383'-AMINO-2'-DEOXY-GUANOSINE-5'-
MONOPHOSPHATE
A,B,C,D,E,F363D0.71
CFFCAFFEINEA,B1L5Q0.78
CFFCAFFEINEA,B2A3B0.78
CFFCAFFEINEA,B1L7X0.78
CFFCAFFEINEA1GFZ0.78
CFFCAFFEINEA,B3DDW0.78
CFFCAFFEINEA,B3DD10.78
CFFCAFFEINEA,B3DDS0.78
CFFCAFFEINEA1C8L0.78
3DG9-(3-DEOXY-BETA-D-RIBOFURANOSYL)GUANINEE1V450.7
37TTHEOBROMINEA2EFJ0.79
GU72-AMINO-7-[2-(2-HYDROXY-1-HYDROXYMETHYL-
ETHYLAMINO)-ETHYL]-1,7-DIHYDRO-
PURIN-6-ONE
A1FXU0.76
8MG8-METHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B1R4D0.7
8MG8-METHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B1TNE0.7