Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00015625

Ligand	Ligand name	Chain	PDB	Tanimoto
APS	9-HYDROXYPROPYLADENINE, S-ISOMER	A,B	1E2I	0.73
A2F	2-fluoroadenine	A	3GOT	0.91
A2F	2-fluoroadenine	A,B,C	3GB9	0.91
ARP	9-HYDROXYPROPYLADENINE, R-ISOMER	A,B	1E2I	0.73
ADZ	9-METHYL-9H-PURIN-6-AMINE	A	1O9U	0.85
IHE	6-(CYCLOHEXYLAMINO)-9-[2-(4-METHYLPIPERAZIN-1-YL)-ETHYL]-9H-PURINE-2-CARBONITRILE	A	1U9V	0.72
ZEA	(2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol	A,B,C,D	2FLH	0.75
ZEA	(2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol	A,B,C,D	3C0V	0.75
ZEA	(2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol	A	2QIM	0.75
ZEA	(2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol	A,B	3D7W	0.75
ZEA	(2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol	A	1W1R	0.75
M01	1-[1-(9H-purin-6-yl)piperidin-4-yl]methanamine	A	2VNW	0.79
M02	1-(9H-purin-6-yl)piperidin-4-amine	A	2VNY	0.82
PM6	9H-purine-6-thiol	A,B	3BGD	0.84
PPZ	2-(PYRIDO[1,2-E]PURIN-4-YL)AMINO-ETHANOL	A,B	1I5V	0.72
CFP	6-CHLORO-2-FLUOROPURINE	A	1JDJ	0.97
ADE	ADENINE	A	1WEI	0.93
ADE	ADENINE	A	2QLU	0.93
ADE	ADENINE	A,B	2H8G	0.93
ADE	ADENINE	A,B	1HQC	0.93
ADE	ADENINE	A	1AHA	0.93
ADE	ADENINE	A,B,C,D,E,F,G,H	1BJQ	0.93
ADE	ADENINE	A,B,D	1YXM	0.93
ADE	ADENINE	A	1CB0	0.93
ADE	ADENINE	A,B	2QTT	0.93
ADE	ADENINE	A,B,C	1XE8	0.93
ADE	ADENINE	A,B	1M2T	0.93
ADE	ADENINE	A	2P8N	0.93
ADE	ADENINE	A,B,C	2PQJ	0.93
ADE	ADENINE	A,B,C	1VRL	0.93
ADE	ADENINE	A,B	3BSF	0.93
ADE	ADENINE	X	1Y26	0.93
ADE	ADENINE	A,B	1ZN7	0.93
ADE	ADENINE	A,B	1Z5N	0.93
ADE	ADENINE	A	1QB7	0.93
ADE	ADENINE	A	1LU1	0.93
ADE	ADENINE	A,B	1Q8Y	0.93
ADE	ADENINE	A	2QES	0.93
ADE	ADENINE	A	2PUB	0.93
ADE	ADENINE	A	1Z8D	0.93
ADE	ADENINE	A	1JH8	0.93
ADE	ADENINE	A	1QD2	0.93
ADE	ADENINE	A	2ICS	0.93
ADE	ADENINE	A	1IFS	0.93
ADE	ADENINE	A	1NLI	0.93
ADE	ADENINE	A,B	1D2A	0.93
ADE	ADENINE	A	1GIU	0.93
ADE	ADENINE	A	1J1R	0.93
ADE	ADENINE	A	2QET	0.93
ADE	ADENINE	A,B,C	1OD4	0.93
ADE	ADENINE	A,B	1QCI	0.93
ADE	ADENINE	A,B,C,D,E,F	2GA4	0.93
ADE	ADENINE	A,B	1JYS	0.93
ADE	ADENINE	A	1LPD	0.93
ADE	ADENINE	A,B	1OD2	0.93
ADE	ADENINE	A	1WTA	0.93
ADE	ADENINE	A,B,C	1S2D	0.93
ADE	ADENINE	A	1MUD	0.93
ADE	ADENINE	A	2PUE	0.93
39A	6-AMINO-3,9-DIMETHYL-9H-PURIN-3-IUM	A,B	1PU7	0.84
EA1	3H-IMIDAZO[2,1-I]PURINE	A,B	1PU8	0.75
5HG	{[2-(6-AMINO-9H-PURIN-9-YL)ETHOXY]METHYL}PHOSPHONIC ACID	A,B	2G1A	0.7
BOA	2-BROMO-6-HYDROXY-PURINE	A	1M67	0.74
6GO	6-O-methylguanine	A	3FO6	0.74
6GO	6-O-methylguanine	A	3GES	0.74
XAN	XANTHINE	A	3GAO	0.71
XAN	XANTHINE	2,3,4,A,B,C,J,K,L,S,T,U	3EUB	0.71
XAN	XANTHINE	A,B,C,D,E,F	1YR3	0.71
XAN	XANTHINE	A	2UZ9	0.71
XAN	XANTHINE	A,B,C,D,E,F,G,H	2W3S	0.71
XAN	XANTHINE	A,B,C,D	1A96	0.71
L21	3-(3-methylbut-2-en-1-yl)-3H-purin-6-amine	A,B	2W6Z	0.72
BP1	6-BROMO-7H-PURINE	A,B,C	1S2I	0.86
203	1,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-4(3H)-ONE 2,2-DIOXIDE	A,B	2IU3	0.7
203	1,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-4(3H)-ONE 2,2-DIOXIDE	A,B	2IU0	0.7
HA8	N6-(buta-2,3-dienyl)adenine	A	3C0P	0.83
301	N6-(penta-2,3-dienyl)adenine	A	3BW7	0.81
DX4	2-amino-1,9-dihydro-6H-purine-6-thione	A,B,C,D	3BMG	0.74
9MG	9-METHYLGUANINE	A	1RRW	0.7
3D3	2-[(6-AMINO-7H-PURIN-8-YL)THIO]ACETAMIDE	A	2CGX	0.77
ZIP	N-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-6-AMINE	A	1W1Q	0.83
ZIP	N-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-6-AMINE	A	2EXM	0.83
ADK	3-METHYL-3H-PURIN-6-YLAMINE	A,B	2OFI	0.79
ADK	3-METHYL-3H-PURIN-6-YLAMINE	A	1P7M	0.79
6AP	9H-PURINE-2,6-DIAMINE	A	2B57	0.93
3MA	6-AMINO-3-METHYLPURINE	A	3MAG	0.9
2BP	9H-purin-2-amine	A	3G4M	0.84
6GU	6-chloroguanine	A	3FO4	1
6GU	6-chloroguanine	A	3GOG	1
6GU	6-chloroguanine	A	3GER	1
6MP	6-METHYLPURINE	A,B,C	1OU4	0.84
6MP	6-METHYLPURINE	A,B,C	1OTY	0.84
6MP	6-METHYLPURINE	A	2PUA	0.84
ZEZ	(2Z)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol	A,B	3D7W	0.75
M1A	6-AMINO-1-METHYLPURINE	A	1B42	0.9
XX1	N~6~-7H-PURIN-6-YL-L-LYSINE	A,B,C,D	2OQF	0.7
BCP	2-BROMO-6-CHLORO-PURINE	A	1M66	0.96
BCP	2-BROMO-6-CHLORO-PURINE	A	1N1G	0.96