Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02082253

Ligand	Ligand name	Chain	PDB	Tanimoto
ZEA	(2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol	A,B,C,D	2FLH	0.74
ZEA	(2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol	A,B,C,D	3C0V	0.74
ZEA	(2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol	A	2QIM	0.74
ZEA	(2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol	A,B	3D7W	0.74
ZEA	(2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol	A	1W1R	0.74
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DY8	0.72
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	2HD1	0.72
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DYN	0.72
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DYS	0.72
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	2YY2	0.72
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3ECN	0.72
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DYL	0.72
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B,C,D	1ZKN	0.72
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	2R8Q	0.72
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B,C,D,E,F,G,H,I,J,K,L	1SOJ	0.72
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DYQ	0.72
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A	1RKP	0.72
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A	1ZKL	0.72
BP1	6-BROMO-7H-PURINE	A,B,C	1S2I	0.71
3D3	2-[(6-AMINO-7H-PURIN-8-YL)THIO]ACETAMIDE	A	2CGX	0.76
M1A	6-AMINO-1-METHYLPURINE	A	1B42	0.77
3MA	6-AMINO-3-METHYLPURINE	A	3MAG	0.77
ZIP	N-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-6-AMINE	A	1W1Q	0.78
ZIP	N-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-6-AMINE	A	2EXM	0.78
39A	6-AMINO-3,9-DIMETHYL-9H-PURIN-3-IUM	A,B	1PU7	0.78
6AP	9H-PURINE-2,6-DIAMINE	A	2B57	0.76
HA8	N6-(buta-2,3-dienyl)adenine	A	3C0P	0.75
PPZ	2-(PYRIDO[1,2-E]PURIN-4-YL)AMINO-ETHANOL	A,B	1I5V	0.75
PM6	9H-purine-6-thiol	A,B	3BGD	0.7
M02	1-(9H-purin-6-yl)piperidin-4-amine	A	2VNY	0.76
CFP	6-CHLORO-2-FLUOROPURINE	A	1JDJ	0.7
5HG	{[2-(6-AMINO-9H-PURIN-9-YL)ETHOXY]METHYL}PHOSPHONIC ACID	A,B	2G1A	0.72
ADK	3-METHYL-3H-PURIN-6-YLAMINE	A,B	2OFI	0.72
ADK	3-METHYL-3H-PURIN-6-YLAMINE	A	1P7M	0.72
IHE	6-(CYCLOHEXYLAMINO)-9-[2-(4-METHYLPIPERAZIN-1-YL)-ETHYL]-9H-PURINE-2-CARBONITRILE	A	1U9V	0.74
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A,B,C,D,E,F,G,H	1QPY	0.81
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A,B	1RRU	0.81
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	B	1PDT	0.81
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A,B	1PUP	0.81
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	B	1NR8	0.81
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A,B	1XJ9	0.81
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A	176D	0.81
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A,B,C,D	1HZS	0.81
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE	A,B	2K4G	0.81
A2F	2-fluoroadenine	A	3GOT	0.75
A2F	2-fluoroadenine	A,B,C	3GB9	0.75
XX1	N~6~-7H-PURIN-6-YL-L-LYSINE	A,B,C,D	2OQF	0.71
L21	3-(3-methylbut-2-en-1-yl)-3H-purin-6-amine	A,B	2W6Z	0.72
301	N6-(penta-2,3-dienyl)adenine	A	3BW7	0.74
ADZ	9-METHYL-9H-PURIN-6-AMINE	A	1O9U	0.77
TNV	[2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYL-TRIPHOSPHATE	A,B,P	1T05	0.7
ADE	ADENINE	A	1WEI	0.76
ADE	ADENINE	A	2QLU	0.76
ADE	ADENINE	A,B	2H8G	0.76
ADE	ADENINE	A,B	1HQC	0.76
ADE	ADENINE	A	1AHA	0.76
ADE	ADENINE	A,B,C,D,E,F,G,H	1BJQ	0.76
ADE	ADENINE	A,B,D	1YXM	0.76
ADE	ADENINE	A	1CB0	0.76
ADE	ADENINE	A,B	2QTT	0.76
ADE	ADENINE	A,B,C	1XE8	0.76
ADE	ADENINE	A,B	1M2T	0.76
ADE	ADENINE	A	2P8N	0.76
ADE	ADENINE	A,B,C	2PQJ	0.76
ADE	ADENINE	A,B,C	1VRL	0.76
ADE	ADENINE	A,B	3BSF	0.76
ADE	ADENINE	X	1Y26	0.76
ADE	ADENINE	A,B	1ZN7	0.76
ADE	ADENINE	A,B	1Z5N	0.76
ADE	ADENINE	A	1QB7	0.76
ADE	ADENINE	A	1LU1	0.76
ADE	ADENINE	A,B	1Q8Y	0.76
ADE	ADENINE	A	2QES	0.76
ADE	ADENINE	A	2PUB	0.76
ADE	ADENINE	A	1Z8D	0.76
ADE	ADENINE	A	1JH8	0.76
ADE	ADENINE	A	1QD2	0.76
ADE	ADENINE	A	2ICS	0.76
ADE	ADENINE	A	1IFS	0.76
ADE	ADENINE	A	1NLI	0.76
ADE	ADENINE	A,B	1D2A	0.76
ADE	ADENINE	A	1GIU	0.76
ADE	ADENINE	A	1J1R	0.76
ADE	ADENINE	A	2QET	0.76
ADE	ADENINE	A,B,C	1OD4	0.76
ADE	ADENINE	A,B	1QCI	0.76
ADE	ADENINE	A,B,C,D,E,F	2GA4	0.76
ADE	ADENINE	A,B	1JYS	0.76
ADE	ADENINE	A	1LPD	0.76
ADE	ADENINE	A,B	1OD2	0.76
ADE	ADENINE	A	1WTA	0.76
ADE	ADENINE	A,B,C	1S2D	0.76
ADE	ADENINE	A	1MUD	0.76
ADE	ADENINE	A	2PUE	0.76
TFO	[2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYLPHOSPHONIC ACID	A,P	1T03	0.72
6MP	6-METHYLPURINE	A,B,C	1OU4	0.73
6MP	6-METHYLPURINE	A,B,C	1OTY	0.73
6MP	6-METHYLPURINE	A	2PUA	0.73
ARP	9-HYDROXYPROPYLADENINE, R-ISOMER	A,B	1E2I	0.76
2BP	9H-purin-2-amine	A	3G4M	0.73
37T	THEOBROMINE	A	2EFJ	0.71
APS	9-HYDROXYPROPYLADENINE, S-ISOMER	A,B	1E2I	0.76
ZEZ	(2Z)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol	A,B	3D7W	0.74
EMA	(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-DIPHOSPHATE	A,B	1ZOT	0.71
EMA	(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-DIPHOSPHATE	A,B,C,D,E,F	1PK0	0.71
M01	1-[1-(9H-purin-6-yl)piperidin-4-yl]methanamine	A	2VNW	0.74
9PP	2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINE	A,B,C,D,E,F	1LVU	0.72
9PP	2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINE	A,B,C,D,E,F	1LV8	0.72
A66	2-AMINOETHYLLYSINE-CARBONYLMETHYLENE-ADENINE	B	1NR8	0.73
6GU	6-chloroguanine	A	3FO4	0.72
6GU	6-chloroguanine	A	3GOG	0.72
6GU	6-chloroguanine	A	3GER	0.72