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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03698137

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2031,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-
4(3H)-ONE 2,2-DIOXIDE
A,B2IU30.76
2031,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-
4(3H)-ONE 2,2-DIOXIDE
A,B2IU00.76
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DY80.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2HD10.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYN0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYS0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2YY20.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3ECN0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYL0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B,C,D1ZKN0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2R8Q0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B,C,D,E,F,
G,H,I,J,K,L
1SOJ0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYQ0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA1RKP0.72
IBM3-ISOBUTYL-1-METHYLXANTHINEA1ZKL0.72
8IG8-IODO-GUANINEA,B,C1C3X0.72
HPAHYPOXANTHINEA1PNR0.8
HPAHYPOXANTHINEA2EET0.8
HPAHYPOXANTHINEA2PUG0.8
HPAHYPOXANTHINEA1A9T0.8
HPAHYPOXANTHINEA1BDI0.8
HPAHYPOXANTHINEA1QQA0.8
HPAHYPOXANTHINEA1VFN0.8
HPAHYPOXANTHINEA1VPW0.8
HPAHYPOXANTHINEA2EEV0.8
HPAHYPOXANTHINEA1A9Q0.8
HPAHYPOXANTHINEA1A9R0.8
HPAHYPOXANTHINEA2EEU0.8
HPAHYPOXANTHINEA,B,C,D,E,F,
G,H
2W550.8
HPAHYPOXANTHINEA1JFT0.8
HPAHYPOXANTHINEA2EEW0.8
HPAHYPOXANTHINEA2PUD0.8
HPAHYPOXANTHINEA1QP70.8
HPAHYPOXANTHINEA,M1ZAY0.8
HPAHYPOXANTHINEA1JH90.8
HPAHYPOXANTHINEA2EES0.8
HPAHYPOXANTHINEA1JFS0.8
HPAHYPOXANTHINEA1QP00.8
HPAHYPOXANTHINEA1QPZ0.8
HPAHYPOXANTHINEA1U8D0.8
HPAHYPOXANTHINEA1QQB0.8
HPAHYPOXANTHINEA1BDH0.8
HPAHYPOXANTHINEA,B,C,D,E,F,
G,H
2W3R0.8
HPAHYPOXANTHINEA1QP40.8
HPAHYPOXANTHINEA,B,C3FNQ0.8
PE29-(4-HYDROXY-3-(HYDROXYMETHYL)BUT-
1-YL)GUANINE
A,B1KI30.72
TEPTHEOPHYLLINEA1EHT0.73
TEPTHEOPHYLLINEA,B2A3A0.73
TEPTHEOPHYLLINEA1O150.73
HGL(2S)-2-amino-4-(2-amino-6-oxo-1,6-
dihydro-9H-purin-9-yl)butanoic acid
A,B,C,D3C1P0.77
SIB(2S)-2-AMINO-4-({[(2S,3S,4R,5R)-
3,4-DIHYDROXY-5-(6-OXO-1,6-DIHYDRO-
9H-PURIN-9-YL)TETRAHYDROFURAN-2-
YL]METHYL}THIO)BUTANOIC ACID
A2PLM0.74
AGD3-(2-amino-6-oxo-1,6-dihydro-9H-
purin-9-yl)-D-alanine
A,B,C,D3C1P0.76
GU72-AMINO-7-[2-(2-HYDROXY-1-HYDROXYMETHYL-
ETHYLAMINO)-ETHYL]-1,7-DIHYDRO-
PURIN-6-ONE
A1FXU0.72
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B,C,D,E,F,
G,H
1QPY0.75
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B1RRU0.75
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
B1PDT0.75
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B1PUP0.75
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
B1NR80.75
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B1XJ90.75
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A176D0.75
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B,C,D1HZS0.75
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE
A,B2K4G0.75
XANXANTHINEA3GAO0.74
XANXANTHINE2,3,4,A,B,C,
J,K,L,S,T,U
3EUB0.74
XANXANTHINEA,B,C,D,E,F1YR30.74
XANXANTHINEA2UZ90.74
XANXANTHINEA,B,C,D,E,F,
G,H
2W3S0.74
XANXANTHINEA,B,C,D1A960.74
AC29-HYROXYETHOXYMETHYLGUANINEA,B2KI50.73
AC29-HYROXYETHOXYMETHYLGUANINEE1PWY0.73
S4GA,B2RMQ0.73
ANG8-AMINOGUANINEA,C1M3Q0.74
ANG8-AMINOGUANINEA,E1LWV0.74
BRG8-BROMOGUANINEA,E1LWW0.72
5AC5-amino-1H-imidazole-4-carboxamideA,B3CL80.76
GA29-(1,3-DIHYDROXY-PROPOXYMETHANE)GUANINEA,B1KI20.7
GUNGUANINEA,B1IT70.8
GUNGUANINEA,B,C,D3BP10.8
GUNGUANINEA1XT40.8
GUNGUANINEA1ULB0.8
GUNGUANINEA,B2I9U0.8
GUNGUANINEA2JH90.8
GUNGUANINEE1V2H0.8
GUNGUANINEA2JHA0.8
GUNGUANINEA,B,C,D1A950.8
GUNGUANINEA,B,C1XE70.8
GUNGUANINEA,B,C1YQQ0.8
GUNGUANINEA,B1D6A0.8
GUNGUANINEA1WET0.8
GUNGUANINEA2PUF0.8
GUNGUANINEA,B,D,F,G,H,
I,J,L,M,O,P
1SQL0.8
GUNGUANINEA,B,C1VMK0.8
GUNGUANINEA,B,C1YQU0.8
GUNGUANINEA2JHC0.8
GUNGUANINEA2JH80.8
GUNGUANINEA2JHP0.8
GUNGUANINEA2PUC0.8
GUNGUANINEA,B,C,D,E,F,
G,H
1XY30.8
GUNGUANINEA,B,C,D,E,F2O740.8
GUNGUANINEA2PWU0.8
GUNGUANINEA2OOD0.8
GUNGUANINEA2POT0.8