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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02255615

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HA8N6-(buta-2,3-dienyl)adenineA3C0P0.74
3D32-[(6-AMINO-7H-PURIN-8-YL)THIO]ACETAMIDEA2CGX0.71
ADK3-METHYL-3H-PURIN-6-YLAMINEA,B2OFI0.74
ADK3-METHYL-3H-PURIN-6-YLAMINEA1P7M0.74
6AP9H-PURINE-2,6-DIAMINEA2B570.76
301N6-(penta-2,3-dienyl)adenineA3BW70.72
LG3PYRIMIDINE-2,4-DIAMINEA2EUN0.78
YF12,5-DIMETHYLPYRIMIDIN-4-AMINEA,B,C,D1T9D0.71
M021-(9H-purin-6-yl)piperidin-4-amineA2VNY0.71
6GU6-chloroguanineA3FO40.71
6GU6-chloroguanineA3GOG0.71
6GU6-chloroguanineA3GER0.71
3MA6-AMINO-3-METHYLPURINEA3MAG0.73
A2F2-fluoroadenineA3GOT0.74
A2F2-fluoroadenineA,B,C3GB90.74
39A6-AMINO-3,9-DIMETHYL-9H-PURIN-3-
IUM
A,B1PU70.75
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
M1A6-AMINO-1-METHYLPURINEA1B420.73
BP16-BROMO-7H-PURINEA,B,C1S2I0.7
NSP5-(AMINOMETHYL)-2-METHYLPYRIMIDIN-
4-AMINE
A,B1T9B0.71
NSP5-(AMINOMETHYL)-2-METHYLPYRIMIDIN-
4-AMINE
I1E800.71
P1RPYRIMIDINEX2GTF0.71
6MP6-METHYLPURINEA,B,C1OU40.7
6MP6-METHYLPURINEA,B,C1OTY0.7
6MP6-METHYLPURINEA2PUA0.7
LGAPYRIMIDIN-2-AMINEA2JJC0.73
EA13H-IMIDAZO[2,1-I]PURINEA,B1PU80.76
ADEADENINEA1WEI0.76
ADEADENINEA2QLU0.76
ADEADENINEA,B2H8G0.76
ADEADENINEA,B1HQC0.76
ADEADENINEA1AHA0.76
ADEADENINEA,B,C,D,E,F,
G,H
1BJQ0.76
ADEADENINEA,B,D1YXM0.76
ADEADENINEA1CB00.76
ADEADENINEA,B2QTT0.76
ADEADENINEA,B,C1XE80.76
ADEADENINEA,B1M2T0.76
ADEADENINEA2P8N0.76
ADEADENINEA,B,C2PQJ0.76
ADEADENINEA,B,C1VRL0.76
ADEADENINEA,B3BSF0.76
ADEADENINEX1Y260.76
ADEADENINEA,B1ZN70.76
ADEADENINEA,B1Z5N0.76
ADEADENINEA1QB70.76
ADEADENINEA1LU10.76
ADEADENINEA,B1Q8Y0.76
ADEADENINEA2QES0.76
ADEADENINEA2PUB0.76
ADEADENINEA1Z8D0.76
ADEADENINEA1JH80.76
ADEADENINEA1QD20.76
ADEADENINEA2ICS0.76
ADEADENINEA1IFS0.76
ADEADENINEA1NLI0.76
ADEADENINEA,B1D2A0.76
ADEADENINEA1GIU0.76
ADEADENINEA1J1R0.76
ADEADENINEA2QET0.76
ADEADENINEA,B,C1OD40.76
ADEADENINEA,B1QCI0.76
ADEADENINEA,B,C,D,E,F2GA40.76
ADEADENINEA,B1JYS0.76
ADEADENINEA1LPD0.76
ADEADENINEA,B1OD20.76
ADEADENINEA1WTA0.76
ADEADENINEA,B,C1S2D0.76
ADEADENINEA1MUD0.76
ADEADENINEA2PUE0.76
PYD2,5-DIMETHYL-PYRIMIDIN-4-YLAMINEA4THI0.71
ADZ9-METHYL-9H-PURIN-6-AMINEA1O9U0.76
L213-(3-methylbut-2-en-1-yl)-3H-purin-
6-amine
A,B2W6Z0.71
2BP9H-purin-2-amineA3G4M0.84
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B,C,D,E,F,
G,H
1QPY0.7
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1RRU0.7
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
B1PDT0.7
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1PUP0.7
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
B1NR80.7
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B1XJ90.7
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A176D0.7
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B,C,D1HZS0.7
APN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
ADENINE
A,B2K4G0.7