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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02466370

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2AMADENOSINE-2'-MONOPHOSPHATEA7RNT0.72
2AMADENOSINE-2'-MONOPHOSPHATEA1PGQ0.72
2AMADENOSINE-2'-MONOPHOSPHATEA6RNT0.72
2AMADENOSINE-2'-MONOPHOSPHATEA1RGK0.72
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B1GAG0.71
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
B,C2G2F0.71
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B,C,D,E,F,
G,H
2G1T0.71
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B2GS60.71
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B,E,F1RQQ0.71
2BUA1U6C0.71
2BUA1U6O0.71
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A1Z350.74
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A2PKK0.74
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A,B,C,D2ZJ00.74
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A,B,C1PK90.74
101A,B,C1CS40.7
3ANA,B,C1HIY0.71
3AM[(2R,3S,4R,5R)-5-(6-aminopurin-
9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-
3-yl] dihydrogen phosphate
A3C0I0.72
3AM[(2R,3S,4R,5R)-5-(6-aminopurin-
9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-
3-yl] dihydrogen phosphate
A,B3C0G0.72
00A5'-O-[(S)-{[(4-chlorophenyl)carbonyl]oxy}(hydroxy)phosphoryl]adenosineX3CW80.72
1AP2,6-DIAMINOPURINE NUCLEOTIDEA1S1K0.7
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,B1D760.7
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,M1ZAY0.7
1AP2,6-DIAMINOPURINE NUCLEOTIDEA211D0.7
1AP2,6-DIAMINOPURINE NUCLEOTIDEC,E3C290.7
1AP2,6-DIAMINOPURINE NUCLEOTIDEA210D0.7
2SA2-[9-(3,4-DIHYDROXY-5-PHOSPHONOOXYMETHYL-
TETRAHYDRO-FURAN-2-YL)-9H-PURIN-
6-YLAMINO]-SUCCINIC ACID
B2PTR0.75
2SA2-[9-(3,4-DIHYDROXY-5-PHOSPHONOOXYMETHYL-
TETRAHYDRO-FURAN-2-YL)-9H-PURIN-
6-YLAMINO]-SUCCINIC ACID
A,B,C,D2VD60.75
2SA2-[9-(3,4-DIHYDROXY-5-PHOSPHONOOXYMETHYL-
TETRAHYDRO-FURAN-2-YL)-9H-PURIN-
6-YLAMINO]-SUCCINIC ACID
A1MEZ0.75
26A6N-DIMETHYLADENOSINEA2A9Y0.76
26A6N-DIMETHYLADENOSINEA2A9Z0.76
3AD3'-DEOXYADENOSINEA,B3B4B0.73
3AD3'-DEOXYADENOSINEA,B3B4C0.73
3AD3'-DEOXYADENOSINEA,B1FA00.73
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A,B,C3GGS0.71
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A1Z340.71
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A,B,C1PKE0.71
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.71
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.71
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.71
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.71
2AR2'-DEOXYARISTEROMYCIN-5'-PHOSPHATEA1EXL0.7
2AR2'-DEOXYARISTEROMYCIN-5'-PHOSPHATEA,B1FYI0.7
2VA2'-(L-VALYL)AMINO-2'-DEOXYADENOSINEA1WNZ0.74
1DG(4R)-ISONICOTINIC-ACETYL-NICOTINAMIDE-
ADENINE DINUCLEOTIDE
A2CIG0.71
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA,B1FA00.72
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA1Q790.72
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA,B,C,D,E,F,
O,P,Q,R,S,T
1XFV0.72
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA,B3C230.72
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA,B,C,D,E,F1K900.72
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA1F5A0.72
3AT3'-DEOXYADENOSINE-5'-TRIPHOSPHATEA1Q780.72
1DA1-DEAZA-ADENOSINEA1ADD0.73