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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02302697

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2098-AMINO-1,3-DIMETHYL-3,7-DIHYDROPURINE-
2,6-DIONE
A1RS20.72
H338-CHLORO-1,3-DIMETHYL-3,7-DIHYDRO-
1H-PURINE-2,6-DIONE
A2UY30.7
AGD3-(2-amino-6-oxo-1,6-dihydro-9H-
purin-9-yl)-D-alanine
A,B,C,D3C1P0.76
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DY80.7
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2HD10.7
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYN0.7
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYS0.7
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2YY20.7
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3ECN0.7
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYL0.7
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B,C,D1ZKN0.7
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2R8Q0.7
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B,C,D,E,F,
G,H,I,J,K,L
1SOJ0.7
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYQ0.7
IBM3-ISOBUTYL-1-METHYLXANTHINEA1RKP0.7
IBM3-ISOBUTYL-1-METHYLXANTHINEA1ZKL0.7
HGL(2S)-2-amino-4-(2-amino-6-oxo-1,6-
dihydro-9H-purin-9-yl)butanoic acid
A,B,C,D3C1P0.73
AC29-HYROXYETHOXYMETHYLGUANINEA,B2KI50.71
AC29-HYROXYETHOXYMETHYLGUANINEE1PWY0.71
GUNGUANINEA,B1IT70.73
GUNGUANINEA,B,C,D3BP10.73
GUNGUANINEA1XT40.73
GUNGUANINEA1ULB0.73
GUNGUANINEA,B2I9U0.73
GUNGUANINEA2JH90.73
GUNGUANINEE1V2H0.73
GUNGUANINEA2JHA0.73
GUNGUANINEA,B,C,D1A950.73
GUNGUANINEA,B,C1XE70.73
GUNGUANINEA,B,C1YQQ0.73
GUNGUANINEA,B1D6A0.73
GUNGUANINEA1WET0.73
GUNGUANINEA2PUF0.73
GUNGUANINEA,B,D,F,G,H,
I,J,L,M,O,P
1SQL0.73
GUNGUANINEA,B,C1VMK0.73
GUNGUANINEA,B,C1YQU0.73
GUNGUANINEA2JHC0.73
GUNGUANINEA2JH80.73
GUNGUANINEA2JHP0.73
GUNGUANINEA2PUC0.73
GUNGUANINEA,B,C,D,E,F,
G,H
1XY30.73
GUNGUANINEA,B,C,D,E,F2O740.73
GUNGUANINEA2PWU0.73
GUNGUANINEA2OOD0.73
GUNGUANINEA2POT0.73
HPAHYPOXANTHINEA1PNR0.73
HPAHYPOXANTHINEA2EET0.73
HPAHYPOXANTHINEA2PUG0.73
HPAHYPOXANTHINEA1A9T0.73
HPAHYPOXANTHINEA1BDI0.73
HPAHYPOXANTHINEA1QQA0.73
HPAHYPOXANTHINEA1VFN0.73
HPAHYPOXANTHINEA1VPW0.73
HPAHYPOXANTHINEA2EEV0.73
HPAHYPOXANTHINEA1A9Q0.73
HPAHYPOXANTHINEA1A9R0.73
HPAHYPOXANTHINEA2EEU0.73
HPAHYPOXANTHINEA,B,C,D,E,F,
G,H
2W550.73
HPAHYPOXANTHINEA1JFT0.73
HPAHYPOXANTHINEA2EEW0.73
HPAHYPOXANTHINEA2PUD0.73
HPAHYPOXANTHINEA1QP70.73
HPAHYPOXANTHINEA,M1ZAY0.73
HPAHYPOXANTHINEA1JH90.73
HPAHYPOXANTHINEA2EES0.73
HPAHYPOXANTHINEA1JFS0.73
HPAHYPOXANTHINEA1QP00.73
HPAHYPOXANTHINEA1QPZ0.73
HPAHYPOXANTHINEA1U8D0.73
HPAHYPOXANTHINEA1QQB0.73
HPAHYPOXANTHINEA1BDH0.73
HPAHYPOXANTHINEA,B,C,D,E,F,
G,H
2W3R0.73
HPAHYPOXANTHINEA1QP40.73
HPAHYPOXANTHINEA,B,C3FNQ0.73
8IG8-IODO-GUANINEA,B,C1C3X0.76
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B,C,D,E,F,
G,H
1QPY0.76
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B1RRU0.76
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
B1PDT0.76
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B1PUP0.76
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
B1NR80.76
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B1XJ90.76
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A176D0.76
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B,C,D1HZS0.76
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B2K4G0.76
BRG8-BROMOGUANINEA,E1LWW0.75
ANG8-AMINOGUANINEA,C1M3Q0.77
ANG8-AMINOGUANINEA,E1LWV0.77
GU72-AMINO-7-[2-(2-HYDROXY-1-HYDROXYMETHYL-
ETHYLAMINO)-ETHYL]-1,7-DIHYDRO-
PURIN-6-ONE
A1FXU0.71