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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02285247

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3D32-[(6-AMINO-7H-PURIN-8-YL)THIO]ACETAMIDEA2CGX0.76
2BUA1U6C0.71
2BUA1U6O0.71
5AD5'-DEOXYADENOSINEA,B,C,D1I9C0.74
5AD5'-DEOXYADENOSINEB1XRS0.74
5AD5'-DEOXYADENOSINEA,B,C2CC20.74
5AD5'-DEOXYADENOSINEA,B2FB30.74
5AD5'-DEOXYADENOSINEA3CI30.74
5AD5'-DEOXYADENOSINEA,B,C,D4REQ0.74
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.72
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.72
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.72
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.72
3MA6-AMINO-3-METHYLPURINEA3MAG0.73
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LVU0.76
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LV80.76
5HG{[2-(6-AMINO-9H-PURIN-9-YL)ETHOXY]METHYL}PHOSPHONIC ACIDA,B2G1A0.77
5AS5'-O-(N-ETHYL-SULFAMOYL)ADENOSINEA1RZY0.73
3L1(2S,3R,5S)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A2ZI40.7
3L1(2S,3R,5S)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B,C,D2ZI50.7
39A6-AMINO-3,9-DIMETHYL-9H-PURIN-3-
IUM
A,B1PU70.73
6MZN6-METHYLADENOSINE-5'-MONOPHOSPHATEA2JRG0.71
6MZN6-METHYLADENOSINE-5'-MONOPHOSPHATEY,Z2UUB0.71
6MZN6-METHYLADENOSINE-5'-MONOPHOSPHATEY,Z2UUA0.71
6MZN6-METHYLADENOSINE-5'-MONOPHOSPHATEY,Z2UUC0.71
6MZN6-METHYLADENOSINE-5'-MONOPHOSPHATEY,Z2UU90.71
6MZN6-METHYLADENOSINE-5'-MONOPHOSPHATEA2JSG0.71
3BH(2R,3R,4S,5R)-2-(6,8-diaminopurin-
9-yl)-5-(hydroxymethyl)oxolane-
3,4-diol
A3FZH0.71
A662-AMINOETHYLLYSINE-CARBONYLMETHYLENE-
ADENINE
B1NR80.7
A8M5'-[(3-aminopropyl)(methyl)amino]-
5'-deoxy-8-methyladenosine
A,B3DZ20.74
3DH5'-S-ethyl-5'-thioadenosineA,B,C,D3DHY0.78
26A6N-DIMETHYLADENOSINEA2A9Y0.71
26A6N-DIMETHYLADENOSINEA2A9Z0.71
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B,C1S2G0.7
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B,C2C5H0.7
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B2Z3M0.7
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B,C,D2ZI60.7
3D1(2R,3S,5R)-5-(6-amino-9H-purin-
9-yl)-tetrahydro-2-(hydroxymethyl)furan-
3-ol
A,B2ZI30.7
3AD3'-DEOXYADENOSINEA,B3B4B0.72
3AD3'-DEOXYADENOSINEA,B3B4C0.72
3AD3'-DEOXYADENOSINEA,B1FA00.72
5F15'-FLUORO-2',5'-DIDEOXYADENOSINEA,B,C2C5B0.71
6IAN6-ISOPENTENYL-ADENOSINE-5'-MONOPHOSPHATEA,B,E,F3EPL0.7
6IAN6-ISOPENTENYL-ADENOSINE-5'-MONOPHOSPHATEX,Y2DLC0.7