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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03077535

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.74
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.74
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.74
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.74
3AM[(2R,3S,4R,5R)-5-(6-aminopurin-
9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-
3-yl] dihydrogen phosphate
A3C0I0.75
3AM[(2R,3S,4R,5R)-5-(6-aminopurin-
9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-
3-yl] dihydrogen phosphate
A,B3C0G0.75
1DG(4R)-ISONICOTINIC-ACETYL-NICOTINAMIDE-
ADENINE DINUCLEOTIDE
A2CIG0.72
1RB1-ALPHA-D-RIBOFURANOSYL-BENZIMIAZOLE-
5'-PHOSPHATE
A1L5K0.81
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,F2ISC0.82
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
B1U1P0.75
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
A,B,C,D,E,F2IBS0.75
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
B1U1R0.75
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
R,S1U1Y0.75
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
A,B,C,D,E,F2IBT0.75
3AA3-AMINOPYRIDINE-ADENINE DINUCLEOTIDE PHOSPHATEA,B,E,F1F6M0.85
101A,B,C1CS40.73
2AMADENOSINE-2'-MONOPHOSPHATEA7RNT0.75
2AMADENOSINE-2'-MONOPHOSPHATEA1PGQ0.75
2AMADENOSINE-2'-MONOPHOSPHATEA6RNT0.75
2AMADENOSINE-2'-MONOPHOSPHATEA1RGK0.75
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A,B,C3GGS0.77
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A1Z340.77
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A,B,C1PKE0.77
2FE2'-fluoro-2'-deoxy-1,N6-ethenoadenineE,G3CWU0.71
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA,B1FA00.73
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA1Q790.73
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA,B,C,D,E,F,
O,P,Q,R,S,T
1XFV0.73
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA,B3C230.73
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA,B,C,D,E,F1K900.73
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA1F5A0.73
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA1Q780.73
2BUA1U6C0.72
2BUA1U6O0.72
26A6N-DIMETHYLADENOSINEA2A9Y0.76
26A6N-DIMETHYLADENOSINEA2A9Z0.76
3ANA,B,C1HIY0.72
1DA1-DEAZA-ADENOSINEA1ADD0.93
3AD3'-DEOXYADENOSINEA,B3B4B0.77
3AD3'-DEOXYADENOSINEA,B3B4C0.77
3AD3'-DEOXYADENOSINEA,B1FA00.77
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A1Z350.79
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A2PKK0.79
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A,B,C,D2ZJ00.79
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A,B,C1PK90.79
1AP2,6-DIAMINOPURINE NUCLEOTIDEA1S1K0.73
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,B1D760.73
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,M1ZAY0.73
1AP2,6-DIAMINOPURINE NUCLEOTIDEA211D0.73
1AP2,6-DIAMINOPURINE NUCLEOTIDEC,E3C290.73
1AP2,6-DIAMINOPURINE NUCLEOTIDEA210D0.73