Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00841958

Ligand	Ligand name	Chain	PDB	Tanimoto
CFF	CAFFEINE	A,B	1L5Q	0.9
CFF	CAFFEINE	A,B	2A3B	0.9
CFF	CAFFEINE	A,B	1L7X	0.9
CFF	CAFFEINE	A	1GFZ	0.9
CFF	CAFFEINE	A,B	3DDW	0.9
CFF	CAFFEINE	A,B	3DD1	0.9
CFF	CAFFEINE	A,B	3DDS	0.9
CFF	CAFFEINE	A	1C8L	0.9
HA1	9-(5,5-DIFLUORO-5-PHOSPHONOPENTYL)GUANINE	A	1V48	0.75
E1X	PHOSPHORIC ACID MONO-[5-(1-ETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-PURIN-9-YL)-3-HYDROXY-TETRAHYDRO-FURAN-2-YLMETHYL]ESTER	C,E	1T39	0.73
HGL	(2S)-2-amino-4-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)butanoic acid	A,B,C,D	3C1P	0.77
203	1,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-4(3H)-ONE 2,2-DIOXIDE	A,B	2IU3	0.8
203	1,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-4(3H)-ONE 2,2-DIOXIDE	A,B	2IU0	0.8
209	8-AMINO-1,3-DIMETHYL-3,7-DIHYDROPURINE-2,6-DIONE	A	1RS2	0.84
AC2	9-HYROXYETHOXYMETHYLGUANINE	A,B	2KI5	0.76
AC2	9-HYROXYETHOXYMETHYLGUANINE	E	1PWY	0.76
ADK	3-METHYL-3H-PURIN-6-YLAMINE	A,B	2OFI	0.7
ADK	3-METHYL-3H-PURIN-6-YLAMINE	A	1P7M	0.7
37T	THEOBROMINE	A	2EFJ	0.91
AGD	3-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-D-alanine	A,B,C,D	3C1P	0.8
GA2	9-(1,3-DIHYDROXY-PROPOXYMETHANE)GUANINE	A,B	1KI2	0.73
A66	2-AMINOETHYLLYSINE-CARBONYLMETHYLENE-ADENINE	B	1NR8	0.7
D1H	1,1'-ETHANE-1,2-DIYLBIS(3,7-DIMETHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE)	A,B	2IUZ	0.91
GUN	GUANINE	A,B	1IT7	0.76
GUN	GUANINE	A,B,C,D	3BP1	0.76
GUN	GUANINE	A	1XT4	0.76
GUN	GUANINE	A	1ULB	0.76
GUN	GUANINE	A,B	2I9U	0.76
GUN	GUANINE	A	2JH9	0.76
GUN	GUANINE	E	1V2H	0.76
GUN	GUANINE	A	2JHA	0.76
GUN	GUANINE	A,B,C,D	1A95	0.76
GUN	GUANINE	A,B,C	1XE7	0.76
GUN	GUANINE	A,B,C	1YQQ	0.76
GUN	GUANINE	A,B	1D6A	0.76
GUN	GUANINE	A	1WET	0.76
GUN	GUANINE	A	2PUF	0.76
GUN	GUANINE	A,B,D,F,G,H,I,J,L,M,O,P	1SQL	0.76
GUN	GUANINE	A,B,C	1VMK	0.76
GUN	GUANINE	A,B,C	1YQU	0.76
GUN	GUANINE	A	2JHC	0.76
GUN	GUANINE	A	2JH8	0.76
GUN	GUANINE	A	2JHP	0.76
GUN	GUANINE	A	2PUC	0.76
GUN	GUANINE	A,B,C,D,E,F,G,H	1XY3	0.76
GUN	GUANINE	A,B,C,D,E,F	2O74	0.76
GUN	GUANINE	A	2PWU	0.76
GUN	GUANINE	A	2OOD	0.76
GUN	GUANINE	A	2POT	0.76
GU7	2-AMINO-7-[2-(2-HYDROXY-1-HYDROXYMETHYL-ETHYLAMINO)-ETHYL]-1,7-DIHYDRO-PURIN-6-ONE	A	1FXU	0.8
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A,B,C,D,E,F,G,H	1QPY	0.77
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A,B	1RRU	0.77
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	B	1PDT	0.77
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A,B	1PUP	0.77
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	B	1NR8	0.77
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A,B	1XJ9	0.77
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A	176D	0.77
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A,B,C,D	1HZS	0.77
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A,B	2K4G	0.77
H33	8-CHLORO-1,3-DIMETHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE	A	2UY3	0.82
5AC	5-amino-1H-imidazole-4-carboxamide	A,B	3CL8	0.76
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-GUANINE	A,B,C,D,E,F,G,H	1QPY	0.83
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-GUANINE	A,B	1RRU	0.83
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-GUANINE	B	1PDT	0.83
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-GUANINE	A,B	1PUP	0.83
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-GUANINE	B	1NR8	0.83
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-GUANINE	A,B	1XJ9	0.83
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-GUANINE	A	176D	0.83
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-GUANINE	A,B,C,D	1HZS	0.83
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-GUANINE	A,B	2K4G	0.83
2DI	9-[(2R,5R)-5-(HYDROXYMETHYL)TETRAHYDROFURAN-2-YL]-1,9-DIHYDRO-6H-PURIN-6-ONE	E	1V3Q	0.7