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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03454235

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
26A6N-DIMETHYLADENOSINEA2A9Y0.77
26A6N-DIMETHYLADENOSINEA2A9Z0.77
2BAA3C210.7
2BAA3C1Y0.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,D,E,H,J3GIJ0.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1T7P0.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,X2PYL0.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1SKR0.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL10.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL20.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1TK80.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,H,P1R0A0.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B1QSY0.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1MQ20.73
103A,B,C1CUL0.74
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
B1U1P0.72
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
A,B,C,D,E,F2IBS0.72
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
B1U1R0.72
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
R,S1U1Y0.72
2PR2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-
9H-PURINE-5'-MONOPHOSPHATE
A,B,C,D,E,F2IBT0.72
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,F2ISC0.71
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A,B,C3GGS0.78
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A1Z340.78
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A,B,C1PKE0.78
3AD3'-DEOXYADENOSINEA,B3B4B0.79
3AD3'-DEOXYADENOSINEA,B3B4C0.79
3AD3'-DEOXYADENOSINEA,B1FA00.79
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A1Z350.78
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A2PKK0.78
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A,B,C,D2ZJ00.78
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A,B,C1PK90.78
101A,B,C1CS40.75
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B1GAG0.7
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
B,C2G2F0.7
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B,C,D,E,F,
G,H
2G1T0.7
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B2GS60.7
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B,E,F1RQQ0.7
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.8
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.8
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.8
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.8
1DA1-DEAZA-ADENOSINEA1ADD0.7
2AMADENOSINE-2'-MONOPHOSPHATEA7RNT0.76
2AMADENOSINE-2'-MONOPHOSPHATEA1PGQ0.76
2AMADENOSINE-2'-MONOPHOSPHATEA6RNT0.76
2AMADENOSINE-2'-MONOPHOSPHATEA1RGK0.76
2AR2'-DEOXYARISTEROMYCIN-5'-PHOSPHATEA1EXL0.75
2AR2'-DEOXYARISTEROMYCIN-5'-PHOSPHATEA,B1FYI0.75
2BUA1U6C0.75
2BUA1U6O0.75
2SA2-[9-(3,4-DIHYDROXY-5-PHOSPHONOOXYMETHYL-
TETRAHYDRO-FURAN-2-YL)-9H-PURIN-
6-YLAMINO]-SUCCINIC ACID
B2PTR0.7
2SA2-[9-(3,4-DIHYDROXY-5-PHOSPHONOOXYMETHYL-
TETRAHYDRO-FURAN-2-YL)-9H-PURIN-
6-YLAMINO]-SUCCINIC ACID
A,B,C,D2VD60.7
2SA2-[9-(3,4-DIHYDROXY-5-PHOSPHONOOXYMETHYL-
TETRAHYDRO-FURAN-2-YL)-9H-PURIN-
6-YLAMINO]-SUCCINIC ACID
A1MEZ0.7
1AP2,6-DIAMINOPURINE NUCLEOTIDEA1S1K0.75
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,B1D760.75
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,M1ZAY0.75
1AP2,6-DIAMINOPURINE NUCLEOTIDEA211D0.75
1AP2,6-DIAMINOPURINE NUCLEOTIDEC,E3C290.75
1AP2,6-DIAMINOPURINE NUCLEOTIDEA210D0.75
2VA2'-(L-VALYL)AMINO-2'-DEOXYADENOSINEA1WNZ0.74