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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03866051

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
26A6N-DIMETHYLADENOSINEA2A9Y0.72
26A6N-DIMETHYLADENOSINEA2A9Z0.72
1DA1-DEAZA-ADENOSINEA1ADD0.79
MDR9-(2-DEOXY-BETA-D-RIBOFURANOSYL)-
6-METHYLPURINE		A,B,C1PR20.74
MDR9-(2-DEOXY-BETA-D-RIBOFURANOSYL)-
6-METHYLPURINE		A,B,C1OVG0.74
PR5B2DD20.73
PR5B2DD10.73
PR5B2DD30.73
PR5A,B,C,D,E,F,
G,H		2B3J0.73
5AS5'-O-(N-ETHYL-SULFAMOYL)ADENOSINEA1RZY0.7
5ID(2R,3R,4S,5R)-2-(4-AMINO-5-IODO-
7H-PYRROLO[2,3-D]PYRIMIDIN-7-YL)-
5-(HYDROXYMETHYL)TETRAHYDROFURAN-
3,4-DIOL		A,B2ZOQ0.89
5ID(2R,3R,4S,5R)-2-(4-AMINO-5-IODO-
7H-PYRROLO[2,3-D]PYRIMIDIN-7-YL)-
5-(HYDROXYMETHYL)TETRAHYDROFURAN-
3,4-DIOL		A2VUW0.89
5ID(2R,3R,4S,5R)-2-(4-AMINO-5-IODO-
7H-PYRROLO[2,3-D]PYRIMIDIN-7-YL)-
5-(HYDROXYMETHYL)TETRAHYDROFURAN-
3,4-DIOL		A,B,C,D2C470.89
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C,D,E,F1M5K0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C3BBI0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B3B5A0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C1X9C0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEC,D1JBS0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B1L3M0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C2D2K0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C,D2FIL0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B2FIJ0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B168D0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,D2D2L0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B3CR10.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C3BBM0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,D1ZFT0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEE,F,G,H,P,Q,
R,S		2NZ40.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C2OUE0.7
A2M2'-O-METHYL-ADENOSINE-5'-MONOPHOSPHATEA,B,C3B5S0.7
RBZALPHA-RIBAZOLE-5'-PHOSPHATEA1D0V0.71
RBZALPHA-RIBAZOLE-5'-PHOSPHATEA1L4E0.71
3BH(2R,3R,4S,5R)-2-(6,8-diaminopurin-
9-yl)-5-(hydroxymethyl)oxolane-
3,4-diol		A3FZH0.72
ADNADENOSINEA2JC90.72
ADNADENOSINEA1PG20.72
ADNADENOSINEA,B,C2ZBV0.72
ADNADENOSINEA2DOJ0.72
ADNADENOSINEA,B,C,D1RMT0.72
ADNADENOSINEA,B2C490.72
ADNADENOSINEA,B,C,D3G1U0.72
ADNADENOSINEA,B1Q970.72
ADNADENOSINEA1N3Z0.72
ADNADENOSINEE1FMO0.72
ADNADENOSINEA,B1HO50.72
ADNADENOSINEA,B,C,D2ZBU0.72
ADNADENOSINEA1MRG0.72
ADNADENOSINEA,B,C2EJF0.72
ADNADENOSINEA1MUO0.72
ADNADENOSINEA,B,C,D,E,F1VHW0.72
ADNADENOSINEA,B,C,D,E,F1JDV0.72
ADNADENOSINEA,B1UAY0.72
ADNADENOSINEA1LIK0.72
ADNADENOSINEA,B,C,D3CE60.72
ADNADENOSINEA,B2EJG0.72
ADNADENOSINEA2PKM0.72
ADNADENOSINEA1YI40.72
ADNADENOSINEA1LII0.72
ADNADENOSINEA2EVA0.72
ADNADENOSINEA2Q6K0.72
ADNADENOSINEA1BX40.72
ADNADENOSINEA,B2AC70.72
ADNADENOSINEA,B2B8J0.72
ADNADENOSINEA2FQY0.72
ADNADENOSINEA1Z370.72
ADNADENOSINEA1MRJ0.72
ADNADENOSINEA,B,C1PK70.72
ADNADENOSINEA2PGF0.72
ADNADENOSINEA,B2ZGW0.72
ADNADENOSINEA,B,C,D1JG30.72
ADNADENOSINEA,B,C1WU80.72
ADNADENOSINEA,B,C,D1XWF0.72
ADNADENOSINEA,B,C,D1V8B0.72
ADNADENOSINEA3REQ0.72
ADNADENOSINEA,B2A8T0.72
ADNADENOSINEA1JG20.72
ADNADENOSINEA,B2Q830.72
ADNADENOSINEA,B2B820.72
ADNADENOSINEA,B,C,D,E,F2GL00.72
ADNADENOSINEA,B2W030.72
ADNADENOSINEA,B,C,D1D4F0.72
ADNADENOSINEA,B2OA10.72
ADNADENOSINEA1DGM0.72
ADNADENOSINEA,B,C,D,E,F1ODI0.72
ADNADENOSINEA3FUU0.72
M8M5'-{[2-(aminooxy)ethyl](methyl)amino}-
5'-deoxy-8-methyladenosine		A,B3DZ50.72
A2LA1XV60.7
7DA7-DEAZA-2'-DEOXYADENOSINE-5'-MONOPHOSPHATEB1U1K0.9
DBM9-(6-DEOXY-BETA-D-ALLOFURANOSYL)-
6-METHYLPURINE		A,B,C1OV60.75
AD33-DEAZA-ADENOSINEA,B1KIE0.8
AD33-DEAZA-ADENOSINEA,B,C,D2ZIZ0.8
AD33-DEAZA-ADENOSINEA,B1R4F0.8
AD33-DEAZA-ADENOSINEA,B1HP00.8
N8M5'-deoxy-5'-(dimethylamino)-8-methyladenosineA,B3H0W0.71
TAP7-THIONICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATEA1DR20.74
TAP7-THIONICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATEA1DR30.74
TAP7-THIONICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATEA,B1PT90.74
QUO2-AMINO-7-DEAZA-(2'',3''-DIHYDROXY-
CYCLOPENTYLAMINO)-GUANOSINE-5'-
MONOPHOSPHATE		A,B1C0A0.71
QUO2-AMINO-7-DEAZA-(2'',3''-DIHYDROXY-
CYCLOPENTYLAMINO)-GUANOSINE-5'-
MONOPHOSPHATE		C,D1EFW0.71
1RB1-ALPHA-D-RIBOFURANOSYL-BENZIMIAZOLE-
5'-PHOSPHATE		A1L5K0.71
GMC(2R,3R,4S,5S)-4-AMINO-2-[6-(DIMETHYLAMINO)-
9H-PURIN-9-YL]-5-(HYDROXYMETHYL)TETRAHYDRO-
3-FURANOL		A1GPJ0.71
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE		B1U1P0.73
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE		A,B,C,D,E,F2IBS0.73
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE		B1U1R0.73
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE		R,S1U1Y0.73
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE		A,B,C,D,E,F2IBT0.73
RAB2-(6-AMINO-PURIN-9-YL)-5-HYDROXYMETHYL-
TETRAHYDRO-FURAN-3,4-DIOL		A,B,C1PW70.72
RAB2-(6-AMINO-PURIN-9-YL)-5-HYDROXYMETHYL-
TETRAHYDRO-FURAN-3,4-DIOL		A,B3GLQ0.72
IDD(5R,6R,7S,8S)-5-(HYDROXYMETHYL)-
2-PHENYL-5,6,7,8-TETRAHYDROIMIDAZO[1,2-
A]PYRIDINE-6,7,8-TRIOL		A1X380.73
IDD(5R,6R,7S,8S)-5-(HYDROXYMETHYL)-
2-PHENYL-5,6,7,8-TETRAHYDROIMIDAZO[1,2-
A]PYRIDINE-6,7,8-TRIOL		A1LQ20.73
XYA2-(6-AMINO-OCTAHYDRO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B2Z3K0.72
XYA2-(6-AMINO-OCTAHYDRO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C1PR60.72
XYA2-(6-AMINO-OCTAHYDRO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A1ZTF0.72
3AA3-AMINOPYRIDINE-ADENINE DINUCLEOTIDE PHOSPHATEA,B,E,F1F6M0.73
5I57-(5-DEOXY-BETA-D-RIBOFURANOSYL)-
5-IODO-7H-PYRROLO[2,3-D]PYRIMIDIN-
4-AMINE		A,B,C,D2I6A0.87
3AD3'-DEOXYADENOSINEA,B3B4B0.71
3AD3'-DEOXYADENOSINEA,B3B4C0.71
3AD3'-DEOXYADENOSINEA,B1FA00.71
EDA3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8-
PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE		A,B150D0.72
EDA3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8-
PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE		A,P,T2DPJ0.72
EDA3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8-
PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE		A,P,T2DPI0.72
EDA3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8-
PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE		A,D1EWN0.72
EDA3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8-
PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE		A,D1F4R0.72
XAE3-(2-DEOXY-5-O-PHOSPHONO-BETA-D-
ERYTHRO-PENTOFURANOSYL)-3H-IMIDAZO[4,5-
G]QUINAZOLIN-8-AMINE		A,B2ICZ0.71
M8E5'-{[4-(aminooxy)butyl](methyl)amino}-
5'-deoxy-8-ethenyladenosine		A,B3DZ60.73
TAL9-(6-DEOXY-ALPHA-L-TALOFURANOSYL)-
6-METHYLPURINE		A,B,C1OUM0.75
AP0ACETYL PYRIDINE ADENINE DINUCLEOTIDE, REDUCEDA,B,C,D2AA30.7
AP0ACETYL PYRIDINE ADENINE DINUCLEOTIDE, REDUCEDA2A940.7
PURPURINE RIBOSIDEA1FKW0.74
PURPURINE RIBOSIDEA1UIP0.74
RPP2-RIBOFURANOSYL-3-IODO-2,3-DIHYDRO-
1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-YLAMINE		A1LIJ0.72
ENAETHENO-NADA,B1ISI0.7
ENAETHENO-NADA1OJU0.7
NBSA1KSW0.71
ABMMETHYL PHOSPHONIC ACID ADENOSINE ESTERA,B1DKU0.7
ABMMETHYL PHOSPHONIC ACID ADENOSINE ESTERA,B1IBS0.7
LMS[(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-
9-YL)-3,4-DIHYDROXYTETRAHYDRO-2-
FURANYL]METHYL SULFAMATE		A1OBC0.7
LMS[(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-
9-YL)-3,4-DIHYDROXYTETRAHYDRO-2-
FURANYL]METHYL SULFAMATE		A2V0C0.7
LMS[(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-
9-YL)-3,4-DIHYDROXYTETRAHYDRO-2-
FURANYL]METHYL SULFAMATE		A1H3N0.7
LMS[(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-
9-YL)-3,4-DIHYDROXYTETRAHYDRO-2-
FURANYL]METHYL SULFAMATE		A1OBH0.7
2FE2'-fluoro-2'-deoxy-1,N6-ethenoadenineE,G3CWU0.71
TBN'2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-
7-YL)-5-HYDROXYMETHYL-TETRAHYDRO-
FURAN-3,4-DIOL		A,B,C1PR50.95
MTU9-BETA-D-RIBOFURANOSYL-9H-PURIN-
2-AMINE		A,C1T0D0.75
MTU9-BETA-D-RIBOFURANOSYL-9H-PURIN-
2-AMINE		B,D2BCY0.75
MTU9-BETA-D-RIBOFURANOSYL-9H-PURIN-
2-AMINE		A,B,C3BBI0.75
MTU9-BETA-D-RIBOFURANOSYL-9H-PURIN-
2-AMINE		A,B,C3B910.75
7GU7-DEAZA-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B2QEF0.76
7GU7-DEAZA-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,C1YQM0.76
7GU7-DEAZA-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B2QEG0.76
7GU7-DEAZA-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEB1U1M0.76
P5PA,B1MV60.73
P5PA,B1MV10.73
P5PA,B1MV20.73
P5PB1XV00.73
P5PA1RBN0.73
SNDTHIONICOTINAMIDE-ADENINE-DINUCLEOTIDEA,B,C,D1IHX0.74
SNDTHIONICOTINAMIDE-ADENINE-DINUCLEOTIDEA,B,C1PTJ0.74
A1P9-{2-DEOXY-5-O-[HYDROXY(OXIDO)PHOSPHINO]-
BETA-L-ERYTHRO-PENTOFURANOSYL}-
9H-PURIN-2-AMINE		A,C,D2C7O0.73
A1P9-{2-DEOXY-5-O-[HYDROXY(OXIDO)PHOSPHINO]-
BETA-L-ERYTHRO-PENTOFURANOSYL}-
9H-PURIN-2-AMINE		A,C2C7P0.73
A1P9-{2-DEOXY-5-O-[HYDROXY(OXIDO)PHOSPHINO]-
BETA-L-ERYTHRO-PENTOFURANOSYL}-
9H-PURIN-2-AMINE		A,C,D2C7R0.73
A1P9-{2-DEOXY-5-O-[HYDROXY(OXIDO)PHOSPHINO]-
BETA-L-ERYTHRO-PENTOFURANOSYL}-
9H-PURIN-2-AMINE		A,C2C7Q0.73
PRXA,B2P2B0.7
PRXA,B2P2M0.7
PRXA,B1PG30.7
PRXA,B1PG40.7
PRXA,B2P2J0.7
PRXA,B2P200.7
PRXA,B2P2Q0.7
DBIPHOSPHORIC ACID MONO-[5-(5,6-DIMETHYL-
BENZOIMIDAZOL-1-YL)-4-HYDROXY-2-
HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-YL] ESTER		A1ID80.71
7RA7-ALPHA-D-RIBOFURANOSYL-2-AMINOPURINE-
5'-PHOSPHATE		A1L5M0.75
MBZ1-[2-DEOXYRIBOFURANOSYL]-4-METHYL-
BENZOIMIDAZOLE-5'-MONOPHOSPHATE		1,21EEK0.71
IDE(5R,6R,7S,8S)-3-(ANILINOMETHYL)-
5,6,7,8-TETRAHYDRO-5-(HYDROXYMETHYL)-
IMIDAZO[1,2-A]PYRIDINE-6,7,8-TRIOL		A1X390.71
IDE(5R,6R,7S,8S)-3-(ANILINOMETHYL)-
5,6,7,8-TETRAHYDRO-5-(HYDROXYMETHYL)-
IMIDAZO[1,2-A]PYRIDINE-6,7,8-TRIOL		A,B2J7C0.71
PQ1PHOSPHORIC ACID MONO-[5-(2-AMINO-
5-AMINOMETHYL-4-OXO-3,5-DIHYDRO-
4H-PYRIDO[2,3-D]PYRIMIDIN-8-YL)-
3,4-DIHYDROXY-TETRAHYDRO-FURAN-
2-YLMETHYL] ESTER		A,B,C,D,E1Q2S0.73
MAOA1I720.71
A8M5'-[(3-aminopropyl)(methyl)amino]-
5'-deoxy-8-methyladenosine		A,B3DZ20.7
7RP7-ALPHA-D-RIBOFURANOSYL-PURINE-
5'-PHOSPHATE		A1L5L0.73
RMBN1-(5'-PHOSPHO-ALPHA-RIBOSYL)-5-
METHYLBENZIMIDAZOLE		A1JHO0.72
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A1Z350.71
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A2PKK0.71
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C,D2ZJ00.71
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C1PK90.71
PRNB1CL80.72
PRNB1U1L0.72
PRNB1U1N0.72
NDA3-AMINOMETHYL-PYRIDINIUM-ADENINE-
DINUCLEOTIDE		A,B,C,D1EBU0.75
P2PN7-(5'-PHOSPHO-ALPHA-RIBOSYL)-2-
HYDROXYPURINE		A1JHR0.73
MTH2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-
7-YL)-5-METHYLSULFANYLMETHYL-TETRAHYDRO-
FURAN-3,4-DIOL		A,B2QTG0.89
MTH2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-
7-YL)-5-METHYLSULFANYLMETHYL-TETRAHYDRO-
FURAN-3,4-DIOL		A,B1NC10.89
MTH2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-
7-YL)-5-METHYLSULFANYLMETHYL-TETRAHYDRO-
FURAN-3,4-DIOL		A1SD20.89