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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03175119

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
101A,B,C1CS40.72
103A,B,C1CUL0.75
37TTHEOBROMINEA2EFJ0.73
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.73
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.73
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.73
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,D,E,H,J3GIJ0.74
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1T7P0.74
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,X2PYL0.74
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1SKR0.74
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL10.74
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL20.74
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1TK80.74
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,H,P1R0A0.74
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B1QSY0.74
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1MQ20.74
2AMADENOSINE-2'-MONOPHOSPHATEA7RNT0.7
2AMADENOSINE-2'-MONOPHOSPHATEA1PGQ0.7
2AMADENOSINE-2'-MONOPHOSPHATEA6RNT0.7
2AMADENOSINE-2'-MONOPHOSPHATEA1RGK0.7
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A,B,C3GGS0.74
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A1Z340.74
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL
A,B,C1PKE0.74
3AM[(2R,3S,4R,5R)-5-(6-aminopurin-
9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-
3-yl] dihydrogen phosphate
A3C0I0.7
3AM[(2R,3S,4R,5R)-5-(6-aminopurin-
9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-
3-yl] dihydrogen phosphate
A,B3C0G0.7
3BH(2R,3R,4S,5R)-2-(6,8-diaminopurin-
9-yl)-5-(hydroxymethyl)oxolane-
3,4-diol
A3FZH0.73
39A6-AMINO-3,9-DIMETHYL-9H-PURIN-3-
IUM
A,B1PU70.84
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A1Z350.72
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A2PKK0.72
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A,B,C,D2ZJ00.72
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL
A,B,C1PK90.72
301N6-(penta-2,3-dienyl)adenineA3BW70.74
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
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B,C1S2G0.75
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B,C2C5H0.75
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B2Z3M0.75
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B,C,D2ZI60.75
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B2ZI30.75
3DH5'-S-ethyl-5'-thioadenosineA,B,C,D3DHY0.7
3AD3'-DEOXYADENOSINEA,B3B4B0.73
3AD3'-DEOXYADENOSINEA,B3B4C0.73
3AD3'-DEOXYADENOSINEA,B1FA00.73
26A6N-DIMETHYLADENOSINEA2A9Y0.71
26A6N-DIMETHYLADENOSINEA2A9Z0.71
3D32-[(6-AMINO-7H-PURIN-8-YL)THIO]ACETAMIDEA2CGX0.75
2AR2'-DEOXYARISTEROMYCIN-5'-PHOSPHATEA1EXL0.7
2AR2'-DEOXYARISTEROMYCIN-5'-PHOSPHATEA,B1FYI0.7