MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02803112

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

Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
2ND	2'-DEOXYINOSINE	A	1Z39	0.73
8IG	8-IODO-GUANINE	A,B,C	1C3X	0.72
GMP	GUANOSINE	A	2GBH	0.71
GMP	GUANOSINE	A	1IH7	0.71
GMP	GUANOSINE	A	2QVN	0.71
GMP	GUANOSINE	A,B	1WAF	0.71
GMP	GUANOSINE	A,B,C,D,E,F	1JE1	0.71
GMP	GUANOSINE	A	3DMH	0.71
GMP	GUANOSINE	E	1RFG	0.71
GMP	GUANOSINE	A	2FQX	0.71
GMP	GUANOSINE	A	3CFO	0.71
GMP	GUANOSINE	A,B	2AN9	0.71
GMP	GUANOSINE	A,B,C,D,E,F	1ODJ	0.71
HPA	HYPOXANTHINE	A	1PNR	0.8
HPA	HYPOXANTHINE	A	2EET	0.8
HPA	HYPOXANTHINE	A	2PUG	0.8
HPA	HYPOXANTHINE	A	1A9T	0.8
HPA	HYPOXANTHINE	A	1BDI	0.8
HPA	HYPOXANTHINE	A	1QQA	0.8
HPA	HYPOXANTHINE	A	1VFN	0.8
HPA	HYPOXANTHINE	A	1VPW	0.8
HPA	HYPOXANTHINE	A	2EEV	0.8
HPA	HYPOXANTHINE	A	1A9Q	0.8
HPA	HYPOXANTHINE	A	1A9R	0.8
HPA	HYPOXANTHINE	A	2EEU	0.8
HPA	HYPOXANTHINE	A,B,C,D,E,F, G,H	2W55	0.8
HPA	HYPOXANTHINE	A	1JFT	0.8
HPA	HYPOXANTHINE	A	2EEW	0.8
HPA	HYPOXANTHINE	A	2PUD	0.8
HPA	HYPOXANTHINE	A	1QP7	0.8
HPA	HYPOXANTHINE	A,M	1ZAY	0.8
HPA	HYPOXANTHINE	A	1JH9	0.8
HPA	HYPOXANTHINE	A	2EES	0.8
HPA	HYPOXANTHINE	A	1JFS	0.8
HPA	HYPOXANTHINE	A	1QP0	0.8
HPA	HYPOXANTHINE	A	1QPZ	0.8
HPA	HYPOXANTHINE	A	1U8D	0.8
HPA	HYPOXANTHINE	A	1QQB	0.8
HPA	HYPOXANTHINE	A	1BDH	0.8
HPA	HYPOXANTHINE	A,B,C,D,E,F, G,H	2W3R	0.8
HPA	HYPOXANTHINE	A	1QP4	0.8
HPA	HYPOXANTHINE	A,B,C	3FNQ	0.8
AC2	9-HYROXYETHOXYMETHYLGUANINE	A,B	2KI5	0.8
AC2	9-HYROXYETHOXYMETHYLGUANINE	E	1PWY	0.8
LGP	N9-1-HYDROXY-PROP-2-OXYMETHYL-GUANINE- 3'-MONOPHOSPHATE	A,B	1AC9	0.75
LGP	N9-1-HYDROXY-PROP-2-OXYMETHYL-GUANINE- 3'-MONOPHOSPHATE	A	2F3T	0.75
HGL	(2S)-2-amino-4-(2-amino-6-oxo-1,6- dihydro-9H-purin-9-yl)butanoic acid	A,B,C,D	3C1P	0.78
AGD	3-(2-amino-6-oxo-1,6-dihydro-9H- purin-9-yl)-D-alanine	A,B,C,D	3C1P	0.81
D1H	1,1'-ETHANE-1,2-DIYLBIS(3,7-DIMETHYL- 3,7-DIHYDRO-1H-PURINE-2,6-DIONE)	A,B	2IUZ	0.79
G31	3'-METHYL-2',3'-DEOXY-GUANOSINE- 5'-MONOPHOSPHATE	A	1D26	0.71
CFF	CAFFEINE	A,B	1L5Q	0.83
CFF	CAFFEINE	A,B	2A3B	0.83
CFF	CAFFEINE	A,B	1L7X	0.83
CFF	CAFFEINE	A	1GFZ	0.83
CFF	CAFFEINE	A,B	3DDW	0.83
CFF	CAFFEINE	A,B	3DD1	0.83
CFF	CAFFEINE	A,B	3DDS	0.83
CFF	CAFFEINE	A	1C8L	0.83
5AC	5-amino-1H-imidazole-4-carboxamide	A,B	3CL8	0.74
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DY8	0.78
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	2HD1	0.78
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DYN	0.78
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DYS	0.78
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	2YY2	0.78
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3ECN	0.78
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DYL	0.78
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B,C,D	1ZKN	0.78
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	2R8Q	0.78
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B,C,D,E,F, G,H,I,J,K,L	1SOJ	0.78
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DYQ	0.78
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A	1RKP	0.78
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A	1ZKL	0.78
PGN	2'-DEOXYGUANOSINE-3',5'-DIPHOSPHATE	A,C	1J9N	0.7
3DG	9-(3-DEOXY-BETA-D-RIBOFURANOSYL)GUANINE	E	1V45	0.71
PNX	3,7-DIMETHYL-1-(5-OXOHEXYL)-3,7- DIHYDRO-1H-PURINE-2,6-DIONE	A,B	2A3C	0.81
GNG	2'-DEOXY-GUANOSINE	A,B,C,D	1NH3	0.72
GNG	2'-DEOXY-GUANOSINE	A,B	3DS7	0.72
GNG	2'-DEOXY-GUANOSINE	A,B	2ZI7	0.72
GNG	2'-DEOXY-GUANOSINE	A,B	2A8G	0.72
209	8-AMINO-1,3-DIMETHYL-3,7-DIHYDROPURINE- 2,6-DIONE	A	1RS2	0.73
GUN	GUANINE	A,B	1IT7	0.79
GUN	GUANINE	A,B,C,D	3BP1	0.79
GUN	GUANINE	A	1XT4	0.79
GUN	GUANINE	A	1ULB	0.79
GUN	GUANINE	A,B	2I9U	0.79
GUN	GUANINE	A	2JH9	0.79
GUN	GUANINE	E	1V2H	0.79
GUN	GUANINE	A	2JHA	0.79
GUN	GUANINE	A,B,C,D	1A95	0.79
GUN	GUANINE	A,B,C	1XE7	0.79
GUN	GUANINE	A,B,C	1YQQ	0.79
GUN	GUANINE	A,B	1D6A	0.79
GUN	GUANINE	A	1WET	0.79
GUN	GUANINE	A	2PUF	0.79
GUN	GUANINE	A,B,D,F,G,H, I,J,L,M,O,P	1SQL	0.79
GUN	GUANINE	A,B,C	1VMK	0.79
GUN	GUANINE	A,B,C	1YQU	0.79
GUN	GUANINE	A	2JHC	0.79
GUN	GUANINE	A	2JH8	0.79
GUN	GUANINE	A	2JHP	0.79
GUN	GUANINE	A	2PUC	0.79
GUN	GUANINE	A,B,C,D,E,F, G,H	1XY3	0.79
GUN	GUANINE	A,B,C,D,E,F	2O74	0.79
GUN	GUANINE	A	2PWU	0.79
GUN	GUANINE	A	2OOD	0.79
GUN	GUANINE	A	2POT	0.79
37T	THEOBROMINE	A	2EFJ	0.8
ANG	8-AMINOGUANINE	A,C	1M3Q	0.74
ANG	8-AMINOGUANINE	A,E	1LWV	0.74
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A,B,C,D,E,F, G,H	1QPY	0.81
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A,B	1RRU	0.81
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	B	1PDT	0.81
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A,B	1PUP	0.81
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	B	1NR8	0.81
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A,B	1XJ9	0.81
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A	176D	0.81
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A,B,C,D	1HZS	0.81
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A,B	2K4G	0.81
XAN	XANTHINE	A	3GAO	0.73
XAN	XANTHINE	2,3,4,A,B,C, J,K,L,S,T,U	3EUB	0.73
XAN	XANTHINE	A,B,C,D,E,F	1YR3	0.73
XAN	XANTHINE	A	2UZ9	0.73
XAN	XANTHINE	A,B,C,D,E,F, G,H	2W3S	0.73
XAN	XANTHINE	A,B,C,D	1A96	0.73
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,B,D,H	2ATL	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,D,H,J	2AU0	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,P	2OZS	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,P	1TK5	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,P,T	2OZM	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,B,P	1T05	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,P,T	1TK0	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,B	1QSS	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,D,E	3GIM	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,B,C,D,E,F	2HVH	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,B,D,E,H	2ASJ	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,P,T	1ZYQ	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,B,C,D,E,F	2HHW	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,B,D,E	2HVI	0.72
DDG	2',3'-DIDEOXY-GUANOSINE-5'-MONOPHOSPHATE	A,B,D,E,H,J	2ASD	0.72
2DI	9-[(2R,5R)-5-(HYDROXYMETHYL)TETRAHYDROFURAN- 2-YL]-1,9-DIHYDRO-6H-PURIN-6-ONE	E	1V3Q	0.75
MG7	7-METHYLGUANOSINE	A	1EQA	0.71
MG7	7-METHYLGUANOSINE	A	4DCG	0.71
203	1,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN- 4(3H)-ONE 2,2-DIOXIDE	A,B	2IU3	0.72
203	1,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN- 4(3H)-ONE 2,2-DIOXIDE	A,B	2IU0	0.72
H33	8-CHLORO-1,3-DIMETHYL-3,7-DIHYDRO- 1H-PURINE-2,6-DIONE	A	2UY3	0.71
BRG	8-BROMOGUANINE	A,E	1LWW	0.72
GU7	2-AMINO-7-[2-(2-HYDROXY-1-HYDROXYMETHYL- ETHYLAMINO)-ETHYL]-1,7-DIHYDRO- PURIN-6-ONE	A	1FXU	0.8
TEP	THEOPHYLLINE	A	1EHT	0.76
TEP	THEOPHYLLINE	A,B	2A3A	0.76
TEP	THEOPHYLLINE	A	1O15	0.76
ZGU	(S)-1'-(2',3'-DIHYDROXYPROPYL)- GUANINE	A	2JJA	0.77
GA2	9-(1,3-DIHYDROXY-PROPOXYMETHANE)GUANINE	A,B	1KI2	0.78
DG3	2'-3'-DIDEOXYGUANOSINE-5'-TRIPHOSPHATE	A,P	3BQ1	0.71
DG3	2'-3'-DIDEOXYGUANOSINE-5'-TRIPHOSPHATE	A,T	1JXL	0.71
DG3	2'-3'-DIDEOXYGUANOSINE-5'-TRIPHOSPHATE	A,B	1QSS	0.71
DG3	2'-3'-DIDEOXYGUANOSINE-5'-TRIPHOSPHATE	A,P	1T7P	0.71
HA1	9-(5,5-DIFLUORO-5-PHOSPHONOPENTYL)GUANINE	A	1V48	0.79
PE2	9-(4-HYDROXY-3-(HYDROXYMETHYL)BUT- 1-YL)GUANINE	A,B	1KI3	0.8
MG1		A	229D	0.71