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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00234350

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
A662-AMINOETHYLLYSINE-CARBONYLMETHYLENE-
ADENINE
B1NR80.76
39A6-AMINO-3,9-DIMETHYL-9H-PURIN-3-
IUM
A,B1PU70.78
5AD5'-DEOXYADENOSINEA,B,C,D1I9C0.7
5AD5'-DEOXYADENOSINEB1XRS0.7
5AD5'-DEOXYADENOSINEA,B,C2CC20.7
5AD5'-DEOXYADENOSINEA,B2FB30.7
5AD5'-DEOXYADENOSINEA3CI30.7
5AD5'-DEOXYADENOSINEA,B,C,D4REQ0.7
3D32-[(6-AMINO-7H-PURIN-8-YL)THIO]ACETAMIDEA2CGX0.8
ADEADENINEA1WEI0.84
ADEADENINEA2QLU0.84
ADEADENINEA,B2H8G0.84
ADEADENINEA,B1HQC0.84
ADEADENINEA1AHA0.84
ADEADENINEA,B,C,D,E,F,
G,H
1BJQ0.84
ADEADENINEA,B,D1YXM0.84
ADEADENINEA1CB00.84
ADEADENINEA,B2QTT0.84
ADEADENINEA,B,C1XE80.84
ADEADENINEA,B1M2T0.84
ADEADENINEA2P8N0.84
ADEADENINEA,B,C2PQJ0.84
ADEADENINEA,B,C1VRL0.84
ADEADENINEA,B3BSF0.84
ADEADENINEX1Y260.84
ADEADENINEA,B1ZN70.84
ADEADENINEA,B1Z5N0.84
ADEADENINEA1QB70.84
ADEADENINEA1LU10.84
ADEADENINEA,B1Q8Y0.84
ADEADENINEA2QES0.84
ADEADENINEA2PUB0.84
ADEADENINEA1Z8D0.84
ADEADENINEA1JH80.84
ADEADENINEA1QD20.84
ADEADENINEA2ICS0.84
ADEADENINEA1IFS0.84
ADEADENINEA1NLI0.84
ADEADENINEA,B1D2A0.84
ADEADENINEA1GIU0.84
ADEADENINEA1J1R0.84
ADEADENINEA2QET0.84
ADEADENINEA,B,C1OD40.84
ADEADENINEA,B1QCI0.84
ADEADENINEA,B,C,D,E,F2GA40.84
ADEADENINEA,B1JYS0.84
ADEADENINEA1LPD0.84
ADEADENINEA,B1OD20.84
ADEADENINEA1WTA0.84
ADEADENINEA,B,C1S2D0.84
ADEADENINEA1MUD0.84
ADEADENINEA2PUE0.84
ADK3-METHYL-3H-PURIN-6-YLAMINEA,B2OFI0.72
ADK3-METHYL-3H-PURIN-6-YLAMINEA1P7M0.72
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
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.7
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.7
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.7
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.7
ADZ9-METHYL-9H-PURIN-6-AMINEA1O9U0.77
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LVU0.75
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LV80.75
AGD3-(2-amino-6-oxo-1,6-dihydro-9H-
purin-9-yl)-D-alanine
A,B,C,D3C1P0.72
6MP6-METHYLPURINEA,B,C1OU40.78
6MP6-METHYLPURINEA,B,C1OTY0.78
6MP6-METHYLPURINEA2PUA0.78
301N6-(penta-2,3-dienyl)adenineA3BW70.79
A2F2-fluoroadenineA3GOT0.83
A2F2-fluoroadenineA,B,C3GB90.83
6AP9H-PURINE-2,6-DIAMINEA2B570.84
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
5F15'-FLUORO-2',5'-DIDEOXYADENOSINEA,B,C2C5B0.71
5HG{[2-(6-AMINO-9H-PURIN-9-YL)ETHOXY]METHYL}PHOSPHONIC ACIDA,B2G1A0.76
2031,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-
4(3H)-ONE 2,2-DIOXIDE
A,B2IU30.74
2031,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-
4(3H)-ONE 2,2-DIOXIDE
A,B2IU00.74
3MA6-AMINO-3-METHYLPURINEA3MAG0.83