MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00138701

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
D1H	1,1'-ETHANE-1,2-DIYLBIS(3,7-DIMETHYL- 3,7-DIHYDRO-1H-PURINE-2,6-DIONE)	A,B	2IUZ	0.81
HA1	9-(5,5-DIFLUORO-5-PHOSPHONOPENTYL)GUANINE	A	1V48	0.73
AGD	3-(2-amino-6-oxo-1,6-dihydro-9H- purin-9-yl)-D-alanine	A,B,C,D	3C1P	0.79
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
APS	9-HYDROXYPROPYLADENINE, S-ISOMER	A,B	1E2I	0.74
XAN	XANTHINE	A	3GAO	0.8
XAN	XANTHINE	2,3,4,A,B,C, J,K,L,S,T,U	3EUB	0.8
XAN	XANTHINE	A,B,C,D,E,F	1YR3	0.8
XAN	XANTHINE	A	2UZ9	0.8
XAN	XANTHINE	A,B,C,D,E,F, G,H	2W3S	0.8
XAN	XANTHINE	A,B,C,D	1A96	0.8
ZGU	(S)-1'-(2',3'-DIHYDROXYPROPYL)- GUANINE	A	2JJA	0.8
ARP	9-HYDROXYPROPYLADENINE, R-ISOMER	A,B	1E2I	0.74
LGP	N9-1-HYDROXY-PROP-2-OXYMETHYL-GUANINE- 3'-MONOPHOSPHATE	A,B	1AC9	0.74
LGP	N9-1-HYDROXY-PROP-2-OXYMETHYL-GUANINE- 3'-MONOPHOSPHATE	A	2F3T	0.74
01G		1	2R75	0.71
AC2	9-HYROXYETHOXYMETHYLGUANINE	A,B	2KI5	0.81
AC2	9-HYROXYETHOXYMETHYLGUANINE	E	1PWY	0.81
5AC	5-amino-1H-imidazole-4-carboxamide	A,B	3CL8	0.7
PNX	3,7-DIMETHYL-1-(5-OXOHEXYL)-3,7- DIHYDRO-1H-PURINE-2,6-DIONE	A,B	2A3C	0.81
93A	[3,4-DIHYDROXY-5R-(2,2,4-TRIOXO- 1,2R,3S,4R-TETRAHYDRO-2L6-IMIDAZO[4,5- C][1,2,6]THIADIAZIN-7-YL)TETRAHYDROFURAN- 2-YL]METHYL DIHYDROGEN PHOSPHATE	A,B	2B1I	0.71
HPA	HYPOXANTHINE	A	1PNR	0.71
HPA	HYPOXANTHINE	A	2EET	0.71
HPA	HYPOXANTHINE	A	2PUG	0.71
HPA	HYPOXANTHINE	A	1A9T	0.71
HPA	HYPOXANTHINE	A	1BDI	0.71
HPA	HYPOXANTHINE	A	1QQA	0.71
HPA	HYPOXANTHINE	A	1VFN	0.71
HPA	HYPOXANTHINE	A	1VPW	0.71
HPA	HYPOXANTHINE	A	2EEV	0.71
HPA	HYPOXANTHINE	A	1A9Q	0.71
HPA	HYPOXANTHINE	A	1A9R	0.71
HPA	HYPOXANTHINE	A	2EEU	0.71
HPA	HYPOXANTHINE	A,B,C,D,E,F, G,H	2W55	0.71
HPA	HYPOXANTHINE	A	1JFT	0.71
HPA	HYPOXANTHINE	A	2EEW	0.71
HPA	HYPOXANTHINE	A	2PUD	0.71
HPA	HYPOXANTHINE	A	1QP7	0.71
HPA	HYPOXANTHINE	A,M	1ZAY	0.71
HPA	HYPOXANTHINE	A	1JH9	0.71
HPA	HYPOXANTHINE	A	2EES	0.71
HPA	HYPOXANTHINE	A	1JFS	0.71
HPA	HYPOXANTHINE	A	1QP0	0.71
HPA	HYPOXANTHINE	A	1QPZ	0.71
HPA	HYPOXANTHINE	A	1U8D	0.71
HPA	HYPOXANTHINE	A	1QQB	0.71
HPA	HYPOXANTHINE	A	1BDH	0.71
HPA	HYPOXANTHINE	A,B,C,D,E,F, G,H	2W3R	0.71
HPA	HYPOXANTHINE	A	1QP4	0.71
HPA	HYPOXANTHINE	A,B,C	3FNQ	0.71
2ND	2'-DEOXYINOSINE	A	1Z39	0.72
MG7	7-METHYLGUANOSINE	A	1EQA	0.73
MG7	7-METHYLGUANOSINE	A	4DCG	0.73
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DY8	0.85
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	2HD1	0.85
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DYN	0.85
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DYS	0.85
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	2YY2	0.85
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3ECN	0.85
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DYL	0.85
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B,C,D	1ZKN	0.85
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	2R8Q	0.85
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B,C,D,E,F, G,H,I,J,K,L	1SOJ	0.85
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A,B	3DYQ	0.85
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A	1RKP	0.85
IBM	3-ISOBUTYL-1-METHYLXANTHINE	A	1ZKL	0.85
35G	GUANOSINE-3',5'-MONOPHOSPHATE	A,B	3DBA	0.71
35G	GUANOSINE-3',5'-MONOPHOSPHATE	A,B	2OUU	0.71
35G	GUANOSINE-3',5'-MONOPHOSPHATE	A,B,C,D,E,F	1BHN	0.71
35G	GUANOSINE-3',5'-MONOPHOSPHATE	A	2K31	0.71
PPZ	2-(PYRIDO[1,2-E]PURIN-4-YL)AMINO- ETHANOL	A,B	1I5V	0.7
209	8-AMINO-1,3-DIMETHYL-3,7-DIHYDROPURINE- 2,6-DIONE	A	1RS2	0.85
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE	A,B,C,D,E,F, G,H	1QPY	0.76
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE	A,B	1RRU	0.76
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE	B	1PDT	0.76
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE	A,B	1PUP	0.76
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE	B	1NR8	0.76
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE	A,B	1XJ9	0.76
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE	A	176D	0.76
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE	A,B,C,D	1HZS	0.76
APN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE	A,B	2K4G	0.76
CFF	CAFFEINE	A,B	1L5Q	0.85
CFF	CAFFEINE	A,B	2A3B	0.85
CFF	CAFFEINE	A,B	1L7X	0.85
CFF	CAFFEINE	A	1GFZ	0.85
CFF	CAFFEINE	A,B	3DDW	0.85
CFF	CAFFEINE	A,B	3DD1	0.85
CFF	CAFFEINE	A,B	3DDS	0.85
CFF	CAFFEINE	A	1C8L	0.85
GU7	2-AMINO-7-[2-(2-HYDROXY-1-HYDROXYMETHYL- ETHYLAMINO)-ETHYL]-1,7-DIHYDRO- PURIN-6-ONE	A	1FXU	0.83
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A,B,C,D	2YWC	0.73
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A,B	3BVJ	0.73
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A,B	2CU0	0.73
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A,B	2CZF	0.73
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A,B	2VXO	0.73
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A,B	3BPW	0.73
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A,B	1QK5	0.73
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A	1MEW	0.73
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A,B	1P4R	0.73
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A	1MEI	0.73
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A,B	1LOL	0.73
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A,B,C,D	1PL0	0.73
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A,B	1M9N	0.73
XMP	XANTHOSINE-5'-MONOPHOSPHATE	A,B,C,D	1PKX	0.73
XTS	9-[(2R,3R,4S,5R)-3,4-DIHYDROXY- 5-(HYDROXYMETHYL)OXOLAN-2-YL]-3H- PURINE-2,6-DIONE	A,C,E,G	2EG5	0.79
GUN	GUANINE	A,B	1IT7	0.71
GUN	GUANINE	A,B,C,D	3BP1	0.71
GUN	GUANINE	A	1XT4	0.71
GUN	GUANINE	A	1ULB	0.71
GUN	GUANINE	A,B	2I9U	0.71
GUN	GUANINE	A	2JH9	0.71
GUN	GUANINE	E	1V2H	0.71
GUN	GUANINE	A	2JHA	0.71
GUN	GUANINE	A,B,C,D	1A95	0.71
GUN	GUANINE	A,B,C	1XE7	0.71
GUN	GUANINE	A,B,C	1YQQ	0.71
GUN	GUANINE	A,B	1D6A	0.71
GUN	GUANINE	A	1WET	0.71
GUN	GUANINE	A	2PUF	0.71
GUN	GUANINE	A,B,D,F,G,H, I,J,L,M,O,P	1SQL	0.71
GUN	GUANINE	A,B,C	1VMK	0.71
GUN	GUANINE	A,B,C	1YQU	0.71
GUN	GUANINE	A	2JHC	0.71
GUN	GUANINE	A	2JH8	0.71
GUN	GUANINE	A	2JHP	0.71
GUN	GUANINE	A	2PUC	0.71
GUN	GUANINE	A,B,C,D,E,F, G,H	1XY3	0.71
GUN	GUANINE	A,B,C,D,E,F	2O74	0.71
GUN	GUANINE	A	2PWU	0.71
GUN	GUANINE	A	2OOD	0.71
GUN	GUANINE	A	2POT	0.71
3DG	9-(3-DEOXY-BETA-D-RIBOFURANOSYL)GUANINE	E	1V45	0.74
13A	7-(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,D	2B1G	0.74
TEP	THEOPHYLLINE	A	1EHT	0.83
TEP	THEOPHYLLINE	A,B	2A3A	0.83
TEP	THEOPHYLLINE	A	1O15	0.83
2DI	9-[(2R,5R)-5-(HYDROXYMETHYL)TETRAHYDROFURAN- 2-YL]-1,9-DIHYDRO-6H-PURIN-6-ONE	E	1V3Q	0.73
PE2	9-(4-HYDROXY-3-(HYDROXYMETHYL)BUT- 1-YL)GUANINE	A,B	1KI3	0.81
NDM	7,9-DIMETHYLGUANINE	A	1JSZ	0.75
PCG	CYCLIC GUANOSINE MONOPHOSPHATE	A,B	1Q3E	0.71
PCG	CYCLIC GUANOSINE MONOPHOSPHATE	A,B	1RL3	0.71
PCG	CYCLIC GUANOSINE MONOPHOSPHATE	A,B	3DYN	0.71
PCG	CYCLIC GUANOSINE MONOPHOSPHATE	A,B,C	1BE4	0.71
PCG	CYCLIC GUANOSINE MONOPHOSPHATE	A,B	3CL1	0.71
PCG	CYCLIC GUANOSINE MONOPHOSPHATE	A,B	3DYL	0.71
PCG	CYCLIC GUANOSINE MONOPHOSPHATE	A,B,C,D	2GX5	0.71
PCG	CYCLIC GUANOSINE MONOPHOSPHATE	A,B	2Q0A	0.71
PCG	CYCLIC GUANOSINE MONOPHOSPHATE	A	1MC0	0.71
PCG	CYCLIC GUANOSINE MONOPHOSPHATE	A,B	3DYQ	0.71
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A,B,C,D,E,F, G,H	1QPY	0.82
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A,B	1RRU	0.82
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	B	1PDT	0.82
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A,B	1PUP	0.82
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	B	1NR8	0.82
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A,B	1XJ9	0.82
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A	176D	0.82
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A,B,C,D	1HZS	0.82
GPN	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- GUANINE	A,B	2K4G	0.82
5CG	5'-CHLORO-5'-DEOXY-GUANOSINE	B,C,E,F,M,P	1M5P	0.71
37T	THEOBROMINE	A	2EFJ	0.87
GA2	9-(1,3-DIHYDROXY-PROPOXYMETHANE)GUANINE	A,B	1KI2	0.78
GNG	2'-DEOXY-GUANOSINE	A,B,C,D	1NH3	0.71
GNG	2'-DEOXY-GUANOSINE	A,B	3DS7	0.71
GNG	2'-DEOXY-GUANOSINE	A,B	2ZI7	0.71
GNG	2'-DEOXY-GUANOSINE	A,B	2A8G	0.71
ANG	8-AMINOGUANINE	A,C	1M3Q	0.7
ANG	8-AMINOGUANINE	A,E	1LWV	0.7
GMP	GUANOSINE	A	2GBH	0.73
GMP	GUANOSINE	A	1IH7	0.73
GMP	GUANOSINE	A	2QVN	0.73
GMP	GUANOSINE	A,B	1WAF	0.73
GMP	GUANOSINE	A,B,C,D,E,F	1JE1	0.73
GMP	GUANOSINE	A	3DMH	0.73
GMP	GUANOSINE	E	1RFG	0.73
GMP	GUANOSINE	A	2FQX	0.73
GMP	GUANOSINE	A	3CFO	0.73
GMP	GUANOSINE	A,B	2AN9	0.73
GMP	GUANOSINE	A,B,C,D,E,F	1ODJ	0.73
H33	8-CHLORO-1,3-DIMETHYL-3,7-DIHYDRO- 1H-PURINE-2,6-DIONE	A	2UY3	0.83
8MG	8-METHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE	A,B	1R4D	0.7
8MG	8-METHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE	A,B	1TNE	0.7
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	0.76
203	1,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN- 4(3H)-ONE 2,2-DIOXIDE	A,B	2IU3	0.74
203	1,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN- 4(3H)-ONE 2,2-DIOXIDE	A,B	2IU0	0.74