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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03672175

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TFO[2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYLPHOSPHONIC ACIDA,P1T030.71
EA13H-IMIDAZO[2,1-I]PURINEA,B1PU80.77
L213-(3-methylbut-2-en-1-yl)-3H-purin-
6-amine
A,B2W6Z0.85
ADK3-METHYL-3H-PURIN-6-YLAMINEA,B2OFI0.93
ADK3-METHYL-3H-PURIN-6-YLAMINEA1P7M0.93
CFP6-CHLORO-2-FLUOROPURINEA1JDJ0.74
HA8N6-(buta-2,3-dienyl)adenineA3C0P0.75
6GU6-chloroguanineA3FO40.76
6GU6-chloroguanineA3GOG0.76
6GU6-chloroguanineA3GER0.76
3MA6-AMINO-3-METHYLPURINEA3MAG0.85
DX42-amino-1,9-dihydro-6H-purine-6-
thione
A,B,C,D3BMG0.79
PPZ2-(PYRIDO[1,2-E]PURIN-4-YL)AMINO-
ETHANOL
A,B1I5V0.72
6AP9H-PURINE-2,6-DIAMINEA2B570.82
5HG{[2-(6-AMINO-9H-PURIN-9-YL)ETHOXY]METHYL}PHOSPHONIC ACIDA,B2G1A0.72
IHE6-(CYCLOHEXYLAMINO)-9-[2-(4-METHYLPIPERAZIN-
1-YL)-ETHYL]-9H-PURINE-2-CARBONITRILE
A1U9V0.74
EMA(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-
DIPHOSPHATE
A,B1ZOT0.7
EMA(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-
DIPHOSPHATE
A,B,C,D,E,F1PK00.7
ZIPN-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-
6-AMINE
A1W1Q0.75
ZIPN-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-
6-AMINE
A2EXM0.75
TEPTHEOPHYLLINEA1EHT0.72
TEPTHEOPHYLLINEA,B2A3A0.72
TEPTHEOPHYLLINEA1O150.72
PM69H-purine-6-thiolA,B3BGD0.75
301N6-(penta-2,3-dienyl)adenineA3BW70.74
39A6-AMINO-3,9-DIMETHYL-9H-PURIN-3-
IUM
A,B1PU70.89
M1A6-AMINO-1-METHYLPURINEA1B420.85
CFFCAFFEINEA,B1L5Q0.73
CFFCAFFEINEA,B2A3B0.73
CFFCAFFEINEA,B1L7X0.73
CFFCAFFEINEA1GFZ0.73
CFFCAFFEINEA,B3DDW0.73
CFFCAFFEINEA,B3DD10.73
CFFCAFFEINEA,B3DDS0.73
CFFCAFFEINEA1C8L0.73
2031,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-
4(3H)-ONE 2,2-DIOXIDE
A,B2IU30.7
2031,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-
4(3H)-ONE 2,2-DIOXIDE
A,B2IU00.7
M021-(9H-purin-6-yl)piperidin-4-amineA2VNY0.75
9MG9-METHYLGUANINEA1RRW0.72
M011-[1-(9H-purin-6-yl)piperidin-4-
yl]methanamine
A2VNW0.72
3D32-[(6-AMINO-7H-PURIN-8-YL)THIO]ACETAMIDEA2CGX0.72
NDM7,9-DIMETHYLGUANINEA1JSZ0.75
BP16-BROMO-7H-PURINEA,B,C1S2I0.75
BCP2-BROMO-6-CHLORO-PURINEA1M660.73
BCP2-BROMO-6-CHLORO-PURINEA1N1G0.73
ARP9-HYDROXYPROPYLADENINE, R-ISOMERA,B1E2I0.76
37TTHEOBROMINEA2EFJ0.76
ADEADENINEA1WEI0.82
ADEADENINEA2QLU0.82
ADEADENINEA,B2H8G0.82
ADEADENINEA,B1HQC0.82
ADEADENINEA1AHA0.82
ADEADENINEA,B,C,D,E,F,
G,H
1BJQ0.82
ADEADENINEA,B,D1YXM0.82
ADEADENINEA1CB00.82
ADEADENINEA,B2QTT0.82
ADEADENINEA,B,C1XE80.82
ADEADENINEA,B1M2T0.82
ADEADENINEA2P8N0.82
ADEADENINEA,B,C2PQJ0.82
ADEADENINEA,B,C1VRL0.82
ADEADENINEA,B3BSF0.82
ADEADENINEX1Y260.82
ADEADENINEA,B1ZN70.82
ADEADENINEA,B1Z5N0.82
ADEADENINEA1QB70.82
ADEADENINEA1LU10.82
ADEADENINEA,B1Q8Y0.82
ADEADENINEA2QES0.82
ADEADENINEA2PUB0.82
ADEADENINEA1Z8D0.82
ADEADENINEA1JH80.82
ADEADENINEA1QD20.82
ADEADENINEA2ICS0.82
ADEADENINEA1IFS0.82
ADEADENINEA1NLI0.82
ADEADENINEA,B1D2A0.82
ADEADENINEA1GIU0.82
ADEADENINEA1J1R0.82
ADEADENINEA2QET0.82
ADEADENINEA,B,C1OD40.82
ADEADENINEA,B1QCI0.82
ADEADENINEA,B,C,D,E,F2GA40.82
ADEADENINEA,B1JYS0.82
ADEADENINEA1LPD0.82
ADEADENINEA,B1OD20.82
ADEADENINEA1WTA0.82
ADEADENINEA,B,C1S2D0.82
ADEADENINEA1MUD0.82
ADEADENINEA2PUE0.82
ADZ9-METHYL-9H-PURIN-6-AMINEA1O9U0.88
APS9-HYDROXYPROPYLADENINE, S-ISOMERA,B1E2I0.76
6MP6-METHYLPURINEA,B,C1OU40.75
6MP6-METHYLPURINEA,B,C1OTY0.75
6MP6-METHYLPURINEA2PUA0.75
2BP9H-purin-2-amineA3G4M0.74
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LVU0.72
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LV80.72
A2F2-fluoroadenineA3GOT0.8
A2F2-fluoroadenineA,B,C3GB90.8