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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03588790

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
6AP9H-PURINE-2,6-DIAMINEA2B570.88
5HG{[2-(6-AMINO-9H-PURIN-9-YL)ETHOXY]METHYL}PHOSPHONIC ACIDA,B2G1A0.75
A2F2-fluoroadenineA3GOT0.86
A2F2-fluoroadenineA,B,C3GB90.86
BCP2-BROMO-6-CHLORO-PURINEA1M660.8
BCP2-BROMO-6-CHLORO-PURINEA1N1G0.8
39A6-AMINO-3,9-DIMETHYL-9H-PURIN-3-
IUM
A,B1PU70.84
ADK3-METHYL-3H-PURIN-6-YLAMINEA,B2OFI0.78
ADK3-METHYL-3H-PURIN-6-YLAMINEA1P7M0.78
6MP6-METHYLPURINEA,B,C1OU40.83
6MP6-METHYLPURINEA,B,C1OTY0.83
6MP6-METHYLPURINEA2PUA0.83
BP16-BROMO-7H-PURINEA,B,C1S2I0.82
301N6-(penta-2,3-dienyl)adenineA3BW70.84
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
BOA2-BROMO-6-HYDROXY-PURINEA1M670.71
3D32-[(6-AMINO-7H-PURIN-8-YL)THIO]ACETAMIDEA2CGX0.78
CFP6-CHLORO-2-FLUOROPURINEA1JDJ0.8
A662-AMINOETHYLLYSINE-CARBONYLMETHYLENE-
ADENINE
B1NR80.7
ADZ9-METHYL-9H-PURIN-6-AMINEA1O9U0.83
ADEADENINEA1WEI0.88
ADEADENINEA2QLU0.88
ADEADENINEA,B2H8G0.88
ADEADENINEA,B1HQC0.88
ADEADENINEA1AHA0.88
ADEADENINEA,B,C,D,E,F,
G,H
1BJQ0.88
ADEADENINEA,B,D1YXM0.88
ADEADENINEA1CB00.88
ADEADENINEA,B2QTT0.88
ADEADENINEA,B,C1XE80.88
ADEADENINEA,B1M2T0.88
ADEADENINEA2P8N0.88
ADEADENINEA,B,C2PQJ0.88
ADEADENINEA,B,C1VRL0.88
ADEADENINEA,B3BSF0.88
ADEADENINEX1Y260.88
ADEADENINEA,B1ZN70.88
ADEADENINEA,B1Z5N0.88
ADEADENINEA1QB70.88
ADEADENINEA1LU10.88
ADEADENINEA,B1Q8Y0.88
ADEADENINEA2QES0.88
ADEADENINEA2PUB0.88
ADEADENINEA1Z8D0.88
ADEADENINEA1JH80.88
ADEADENINEA1QD20.88
ADEADENINEA2ICS0.88
ADEADENINEA1IFS0.88
ADEADENINEA1NLI0.88
ADEADENINEA,B1D2A0.88
ADEADENINEA1GIU0.88
ADEADENINEA1J1R0.88
ADEADENINEA2QET0.88
ADEADENINEA,B,C1OD40.88
ADEADENINEA,B1QCI0.88
ADEADENINEA,B,C,D,E,F2GA40.88
ADEADENINEA,B1JYS0.88
ADEADENINEA1LPD0.88
ADEADENINEA,B1OD20.88
ADEADENINEA1WTA0.88
ADEADENINEA,B,C1S2D0.88
ADEADENINEA1MUD0.88
ADEADENINEA2PUE0.88
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B,C,D,E,F,
G,H
1QPY0.77
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1RRU0.77
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
B1PDT0.77
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1PUP0.77
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
B1NR80.77
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1XJ90.77
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A176D0.77
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B,C,D1HZS0.77
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B2K4G0.77
3MA6-AMINO-3-METHYLPURINEA3MAG0.9
ARP9-HYDROXYPROPYLADENINE, R-ISOMERA,B1E2I0.79
APS9-HYDROXYPROPYLADENINE, S-ISOMERA,B1E2I0.79