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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02421706

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2MCMETHACRYLYL-COENZYME AA,B,C,D1RX00.71
101A,B,C1CS40.72
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A,B,C3GGS0.73
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A1Z340.73
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A,B,C1PKE0.73
3AM[(2R,3S,4R,5R)-5-(6-aminopurin-
9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-
3-yl] dihydrogen phosphate
A3C0I0.73
3AM[(2R,3S,4R,5R)-5-(6-aminopurin-
9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-
3-yl] dihydrogen phosphate
A,B3C0G0.73
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A1Z350.75
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A2PKK0.75
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A,B,C,D2ZJ00.75
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A,B,C1PK90.75
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.73
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.73
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.73
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.73
01KA3BIY0.72
26A6N-DIMETHYLADENOSINEA2A9Y0.78
26A6N-DIMETHYLADENOSINEA2A9Z0.78
103A,B,C1CUL0.7
2AMADENOSINE-2'-MONOPHOSPHATEA7RNT0.73
2AMADENOSINE-2'-MONOPHOSPHATEA1PGQ0.73
2AMADENOSINE-2'-MONOPHOSPHATEA6RNT0.73
2AMADENOSINE-2'-MONOPHOSPHATEA1RGK0.73
12A2-METHYLTHIO-N6-(AMINOCARBONYL-
L-THREONYL)-ADENOSINE-5'-MONOPHOSPHATE
A1FIR0.76
1AP2,6-DIAMINOPURINE NUCLEOTIDEA1S1K0.72
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,B1D760.72
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,M1ZAY0.72
1AP2,6-DIAMINOPURINE NUCLEOTIDEA211D0.72
1AP2,6-DIAMINOPURINE NUCLEOTIDEC,E3C290.72
1AP2,6-DIAMINOPURINE NUCLEOTIDEA210D0.72
3AD3'-DEOXYADENOSINEA,B3B4B0.75
3AD3'-DEOXYADENOSINEA,B3B4C0.75
3AD3'-DEOXYADENOSINEA,B1FA00.75
2BUA1U6C0.72
2BUA1U6O0.72
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
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B1GAG0.75
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
B,C2G2F0.75
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B,C,D,E,F,
G,H
2G1T0.75
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B2GS60.75
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER
A,B,E,F1RQQ0.75
3ANA,B,C1HIY0.72
2VA2'-(L-VALYL)AMINO-2'-DEOXYADENOSINEA1WNZ0.73
2CP2-CARBOXYPROPYL-COENZYME AA1EF90.74
2CP2-CARBOXYPROPYL-COENZYME AA,B,C,D7REQ0.74