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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03782825

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
7RP7-ALPHA-D-RIBOFURANOSYL-PURINE-
5'-PHOSPHATE
A1L5L0.71
NBSA1KSW0.7
1DA1-DEAZA-ADENOSINEA1ADD0.79
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.73
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.73
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.73
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.73
MDR9-(2-DEOXY-BETA-D-RIBOFURANOSYL)-
6-METHYLPURINE
A,B,C1PR20.73
MDR9-(2-DEOXY-BETA-D-RIBOFURANOSYL)-
6-METHYLPURINE
A,B,C1OVG0.73
TBN'2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-
7-YL)-5-HYDROXYMETHYL-TETRAHYDRO-
FURAN-3,4-DIOL
A,B,C1PR50.94
MTH2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-
7-YL)-5-METHYLSULFANYLMETHYL-TETRAHYDRO-
FURAN-3,4-DIOL
A,B2QTG0.87
MTH2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-
7-YL)-5-METHYLSULFANYLMETHYL-TETRAHYDRO-
FURAN-3,4-DIOL
A,B1NC10.87
MTH2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-
7-YL)-5-METHYLSULFANYLMETHYL-TETRAHYDRO-
FURAN-3,4-DIOL
A1SD20.87
7GU7-DEAZA-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B2QEF0.73
7GU7-DEAZA-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,C1YQM0.73
7GU7-DEAZA-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B2QEG0.73
7GU7-DEAZA-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEB1U1M0.73
A8M5'-[(3-aminopropyl)(methyl)amino]-
5'-deoxy-8-methyladenosine
A,B3DZ20.71
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
3L1(2S,3R,5S)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A2ZI40.7
3L1(2S,3R,5S)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B,C,D2ZI50.7
3AA3-AMINOPYRIDINE-ADENINE DINUCLEOTIDE PHOSPHATEA,B,E,F1F6M0.73
P5PA,B1MV60.71
P5PA,B1MV10.71
P5PA,B1MV20.71
P5PB1XV00.71
P5PA1RBN0.71
TAP7-THIONICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATEA1DR20.73
TAP7-THIONICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATEA1DR30.73
TAP7-THIONICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATEA,B1PT90.73
PURPURINE RIBOSIDEA1FKW0.74
PURPURINE RIBOSIDEA1UIP0.74
SNDTHIONICOTINAMIDE-ADENINE-DINUCLEOTIDEA,B,C,D1IHX0.73
SNDTHIONICOTINAMIDE-ADENINE-DINUCLEOTIDEA,B,C1PTJ0.73
DBM9-(6-DEOXY-BETA-D-ALLOFURANOSYL)-
6-METHYLPURINE
A,B,C1OV60.71
P2PN7-(5'-PHOSPHO-ALPHA-RIBOSYL)-2-
HYDROXYPURINE
A1JHR0.7
M8E5'-{[4-(aminooxy)butyl](methyl)amino}-
5'-deoxy-8-ethenyladenosine
A,B3DZ60.71
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
FYAADENOSINE-5'-[PHENYLALANINOL-PHOSPHATE]A,B2IY50.71
FYAADENOSINE-5'-[PHENYLALANINOL-PHOSPHATE]A1B7Y0.71
TAL9-(6-DEOXY-ALPHA-L-TALOFURANOSYL)-
6-METHYLPURINE
A,B,C1OUM0.71
223(3R,4R)-1-[(4-AMINO-5H-PYRROLO[3,2-
D]PYRIMIDIN-7-YL)METHYL]-4-(HYDROXYMETHYL)PYRROLIDIN-
3-OL
A,B,C,D,E,F2ISC0.7
AD33-DEAZA-ADENOSINEA,B1KIE0.77
AD33-DEAZA-ADENOSINEA,B,C,D2ZIZ0.77
AD33-DEAZA-ADENOSINEA,B1R4F0.77
AD33-DEAZA-ADENOSINEA,B1HP00.77
7DA7-DEAZA-2'-DEOXYADENOSINE-5'-MONOPHOSPHATEB1U1K0.91
7RA7-ALPHA-D-RIBOFURANOSYL-2-AMINOPURINE-
5'-PHOSPHATE
A1L5M0.72
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B,C1S2G0.7
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B,C2C5H0.7
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B2Z3M0.7
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B,C,D2ZI60.7
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B2ZI30.7
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,B2ZOQ0.88
5ID(2R,3R,4S,5R)-2-(4-AMINO-5-IODO-
7H-PYRROLO[2,3-D]PYRIMIDIN-7-YL)-
5-(HYDROXYMETHYL)TETRAHYDROFURAN-
3,4-DIOL
A2VUW0.88
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,D2C470.88
N8M5'-deoxy-5'-(dimethylamino)-8-methyladenosineA,B3H0W0.7
PRNB1CL80.72
PRNB1U1L0.72
PRNB1U1N0.72
NDA3-AMINOMETHYL-PYRIDINIUM-ADENINE-
DINUCLEOTIDE
A,B,C,D1EBU0.75
PR5B2DD20.71
PR5B2DD10.71
PR5B2DD30.71
PR5A,B,C,D,E,F,
G,H
2B3J0.71
MTU9-BETA-D-RIBOFURANOSYL-9H-PURIN-
2-AMINE
A,C1T0D0.72
MTU9-BETA-D-RIBOFURANOSYL-9H-PURIN-
2-AMINE
B,D2BCY0.72
MTU9-BETA-D-RIBOFURANOSYL-9H-PURIN-
2-AMINE
A,B,C3BBI0.72
MTU9-BETA-D-RIBOFURANOSYL-9H-PURIN-
2-AMINE
A,B,C3B910.72
GMC(2R,3R,4S,5S)-4-AMINO-2-[6-(DIMETHYLAMINO)-
9H-PURIN-9-YL]-5-(HYDROXYMETHYL)TETRAHYDRO-
3-FURANOL
A1GPJ0.72
5I57-(5-DEOXY-BETA-D-RIBOFURANOSYL)-
5-IODO-7H-PYRROLO[2,3-D]PYRIMIDIN-
4-AMINE
A,B,C,D2I6A0.86