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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02630792

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BP16-BROMO-7H-PURINEA,B,C1S2I0.71
2BP9H-purin-2-amineA3G4M0.71
ZEZ(2Z)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol
A,B3D7W0.71
HA8N6-(buta-2,3-dienyl)adenineA3C0P0.73
301N6-(penta-2,3-dienyl)adenineA3BW70.72
ADZ9-METHYL-9H-PURIN-6-AMINEA1O9U0.7
A2F2-fluoroadenineA3GOT0.74
A2F2-fluoroadenineA,B,C3GB90.74
ADEADENINEA1WEI0.75
ADEADENINEA2QLU0.75
ADEADENINEA,B2H8G0.75
ADEADENINEA,B1HQC0.75
ADEADENINEA1AHA0.75
ADEADENINEA,B,C,D,E,F,
G,H
1BJQ0.75
ADEADENINEA,B,D1YXM0.75
ADEADENINEA1CB00.75
ADEADENINEA,B2QTT0.75
ADEADENINEA,B,C1XE80.75
ADEADENINEA,B1M2T0.75
ADEADENINEA2P8N0.75
ADEADENINEA,B,C2PQJ0.75
ADEADENINEA,B,C1VRL0.75
ADEADENINEA,B3BSF0.75
ADEADENINEX1Y260.75
ADEADENINEA,B1ZN70.75
ADEADENINEA,B1Z5N0.75
ADEADENINEA1QB70.75
ADEADENINEA1LU10.75
ADEADENINEA,B1Q8Y0.75
ADEADENINEA2QES0.75
ADEADENINEA2PUB0.75
ADEADENINEA1Z8D0.75
ADEADENINEA1JH80.75
ADEADENINEA1QD20.75
ADEADENINEA2ICS0.75
ADEADENINEA1IFS0.75
ADEADENINEA1NLI0.75
ADEADENINEA,B1D2A0.75
ADEADENINEA1GIU0.75
ADEADENINEA1J1R0.75
ADEADENINEA2QET0.75
ADEADENINEA,B,C1OD40.75
ADEADENINEA,B1QCI0.75
ADEADENINEA,B,C,D,E,F2GA40.75
ADEADENINEA,B1JYS0.75
ADEADENINEA1LPD0.75
ADEADENINEA,B1OD20.75
ADEADENINEA1WTA0.75
ADEADENINEA,B,C1S2D0.75
ADEADENINEA1MUD0.75
ADEADENINEA2PUE0.75
ZIPN-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-
6-AMINE
A1W1Q0.73
ZIPN-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-
6-AMINE
A2EXM0.73
XX1N~6~-7H-PURIN-6-YL-L-LYSINEA,B,C,D2OQF0.74
3MA6-AMINO-3-METHYLPURINEA3MAG0.76
M1A6-AMINO-1-METHYLPURINEA1B420.76
PM69H-purine-6-thiolA,B3BGD0.81
39A6-AMINO-3,9-DIMETHYL-9H-PURIN-3-
IUM
A,B1PU70.71
6MP6-METHYLPURINEA,B,C1OU40.72
6MP6-METHYLPURINEA,B,C1OTY0.72
6MP6-METHYLPURINEA2PUA0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B,C,D,E,F,
G,H
1QPY0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1RRU0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
B1PDT0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1PUP0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
B1NR80.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1XJ90.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A176D0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B,C,D1HZS0.72
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B2K4G0.72
3D32-[(6-AMINO-7H-PURIN-8-YL)THIO]ACETAMIDEA2CGX0.85
6AP9H-PURINE-2,6-DIAMINEA2B570.75
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol
A,B,C,D2FLH0.71
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol
A,B,C,D3C0V0.71
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol
A2QIM0.71
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol
A,B3D7W0.71
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol
A1W1R0.71
M021-(9H-purin-6-yl)piperidin-4-amineA2VNY0.72