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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00490601

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,B2IU30.71
2031,5-DIHYDROIMIDAZO[4,5-C][1,2,6]THIADIAZIN-
4(3H)-ONE 2,2-DIOXIDE		A,B2IU00.71
H338-CHLORO-1,3-DIMETHYL-3,7-DIHYDRO-
1H-PURINE-2,6-DIONE		A2UY30.72
MG77-METHYLGUANOSINEA1EQA0.72
MG77-METHYLGUANOSINEA4DCG0.72
GMPGUANOSINEA2GBH0.71
GMPGUANOSINEA1IH70.71
GMPGUANOSINEA2QVN0.71
GMPGUANOSINEA,B1WAF0.71
GMPGUANOSINEA,B,C,D,E,F1JE10.71
GMPGUANOSINEA3DMH0.71
GMPGUANOSINEE1RFG0.71
GMPGUANOSINEA2FQX0.71
GMPGUANOSINEA3CFO0.71
GMPGUANOSINEA,B2AN90.71
GMPGUANOSINEA,B,C,D,E,F1ODJ0.71
D1H1,1'-ETHANE-1,2-DIYLBIS(3,7-DIMETHYL-
3,7-DIHYDRO-1H-PURINE-2,6-DIONE)		A,B2IUZ0.71
LGPN9-1-HYDROXY-PROP-2-OXYMETHYL-GUANINE-
3'-MONOPHOSPHATE		A,B1AC90.73
LGPN9-1-HYDROXY-PROP-2-OXYMETHYL-GUANINE-
3'-MONOPHOSPHATE		A2F3T0.73
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A,B,C,D2NYN0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A,B,C,D,E,F,
G,H		2O6Y0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A,B,C,D,E,F,
G,H		2O780.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A,B,C,D,E,F,
G,H		2O7F0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A,B2RJR0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A,B,C,D,E,F,
G,H		2O7E0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A2NYF0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A,B,C,D,E,F,
G,H		2O7B0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A,B2QVE0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A,B,C,D3CZO0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A,B2RJS0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A,B2OHY0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A,B,C,D,E,F,
G,H		2O7D0.72
MDO{2-[(1S)-1-AMINOETHYL]-5-HYDROXY-
4-METHYL-1H-IMIDAZOL-1-YL}ACETIC ACID		A,B1W270.72
XTS9-[(2R,3R,4S,5R)-3,4-DIHYDROXY-
5-(HYDROXYMETHYL)OXOLAN-2-YL]-3H-
PURINE-2,6-DIONE		A,C,E,G2EG50.7
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE		A,B,C,D,E,F,
G,H		1QPY0.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE		A,B1RRU0.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE		B1PDT0.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE		A,B1PUP0.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE		B1NR80.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE		A,B1XJ90.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE		A176D0.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE		A,B,C,D1HZS0.78
GPN2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-
GUANINE		A,B2K4G0.78
PNX3,7-DIMETHYL-1-(5-OXOHEXYL)-3,7-
DIHYDRO-1H-PURINE-2,6-DIONE		A,B2A3C0.71
2098-AMINO-1,3-DIMETHYL-3,7-DIHYDROPURINE-
2,6-DIONE		A1RS20.74
HGL(2S)-2-amino-4-(2-amino-6-oxo-1,6-
dihydro-9H-purin-9-yl)butanoic acid		A,B,C,D3C1P0.75
13A7-(3,4-DIHYDROXY-5R-HYDROXYMETHYLTETRAHYDROFURAN-
2-YL)-2,2-DIOXO-1,2R,3R,7-TETRAHYDRO-
2L6-IMIDAZO[4,5-C][1,2,6]THIADIAZIN-
4S-ONE		A,B,C,D2B1G0.71
GA29-(1,3-DIHYDROXY-PROPOXYMETHANE)GUANINEA,B1KI20.76
2ND2'-DEOXYINOSINEA1Z390.7
HPAHYPOXANTHINEA1PNR0.71
HPAHYPOXANTHINEA2EET0.71
HPAHYPOXANTHINEA2PUG0.71
HPAHYPOXANTHINEA1A9T0.71
HPAHYPOXANTHINEA1BDI0.71
HPAHYPOXANTHINEA1QQA0.71
HPAHYPOXANTHINEA1VFN0.71
HPAHYPOXANTHINEA1VPW0.71
HPAHYPOXANTHINEA2EEV0.71
HPAHYPOXANTHINEA1A9Q0.71
HPAHYPOXANTHINEA1A9R0.71
HPAHYPOXANTHINEA2EEU0.71
HPAHYPOXANTHINEA,B,C,D,E,F,
G,H		2W550.71
HPAHYPOXANTHINEA1JFT0.71
HPAHYPOXANTHINEA2EEW0.71
HPAHYPOXANTHINEA2PUD0.71
HPAHYPOXANTHINEA1QP70.71
HPAHYPOXANTHINEA,M1ZAY0.71
HPAHYPOXANTHINEA1JH90.71
HPAHYPOXANTHINEA2EES0.71
HPAHYPOXANTHINEA1JFS0.71
HPAHYPOXANTHINEA1QP00.71
HPAHYPOXANTHINEA1QPZ0.71
HPAHYPOXANTHINEA1U8D0.71
HPAHYPOXANTHINEA1QQB0.71
HPAHYPOXANTHINEA1BDH0.71
HPAHYPOXANTHINEA,B,C,D,E,F,
G,H		2W3R0.71
HPAHYPOXANTHINEA1QP40.71
HPAHYPOXANTHINEA,B,C3FNQ0.71
GNG2'-DEOXY-GUANOSINEA,B,C,D1NH30.72
GNG2'-DEOXY-GUANOSINEA,B3DS70.72
GNG2'-DEOXY-GUANOSINEA,B2ZI70.72
GNG2'-DEOXY-GUANOSINEA,B2A8G0.72
8MG8-METHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B1R4D0.71
8MG8-METHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATEA,B1TNE0.71
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DY80.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2HD10.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYN0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYS0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2YY20.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3ECN0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYL0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B,C,D1ZKN0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B2R8Q0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B,C,D,E,F,
G,H,I,J,K,L		1SOJ0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA,B3DYQ0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA1RKP0.73
IBM3-ISOBUTYL-1-METHYLXANTHINEA1ZKL0.73
NDM7,9-DIMETHYLGUANINEA1JSZ0.71
TEPTHEOPHYLLINEA1EHT0.72
TEPTHEOPHYLLINEA,B2A3A0.72
TEPTHEOPHYLLINEA1O150.72
AC29-HYROXYETHOXYMETHYLGUANINEA,B2KI50.79
AC29-HYROXYETHOXYMETHYLGUANINEE1PWY0.79
HA19-(5,5-DIFLUORO-5-PHOSPHONOPENTYL)GUANINEA1V480.72
AGD3-(2-amino-6-oxo-1,6-dihydro-9H-
purin-9-yl)-D-alanine		A,B,C,D3C1P0.77
PE29-(4-HYDROXY-3-(HYDROXYMETHYL)BUT-
1-YL)GUANINE		A,B1KI30.79
AMZAMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDEA,B1P4R0.72
AMZAMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDEE,G2QRE0.72
AMZAMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDEA,B,C,D1PL00.72
AMZAMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDEA,B1M9N0.72
AMZAMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDEA,B,C,D2NTL0.72
AMZAMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDEA2UV50.72
AMZAMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDEA2R7K0.72
AMZAMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDEA2R7L0.72
AMZAMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDEA,B2R840.72
AMZAMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDEA2CNQ0.72
GU72-AMINO-7-[2-(2-HYDROXY-1-HYDROXYMETHYL-
ETHYLAMINO)-ETHYL]-1,7-DIHYDRO-
PURIN-6-ONE		A1FXU0.82
CFFCAFFEINEA,B1L5Q0.75
CFFCAFFEINEA,B2A3B0.75
CFFCAFFEINEA,B1L7X0.75
CFFCAFFEINEA1GFZ0.75
CFFCAFFEINEA,B3DDW0.75
CFFCAFFEINEA,B3DD10.75
CFFCAFFEINEA,B3DDS0.75
CFFCAFFEINEA1C8L0.75
GUNGUANINEA,B1IT70.71
GUNGUANINEA,B,C,D3BP10.71
GUNGUANINEA1XT40.71
GUNGUANINEA1ULB0.71
GUNGUANINEA,B2I9U0.71
GUNGUANINEA2JH90.71
GUNGUANINEE1V2H0.71
GUNGUANINEA2JHA0.71
GUNGUANINEA,B,C,D1A950.71
GUNGUANINEA,B,C1XE70.71
GUNGUANINEA,B,C1YQQ0.71
GUNGUANINEA,B1D6A0.71
GUNGUANINEA1WET0.71
GUNGUANINEA2PUF0.71
GUNGUANINEA,B,D,F,G,H,
I,J,L,M,O,P		1SQL0.71
GUNGUANINEA,B,C1VMK0.71
GUNGUANINEA,B,C1YQU0.71
GUNGUANINEA2JHC0.71
GUNGUANINEA2JH80.71
GUNGUANINEA2JHP0.71
GUNGUANINEA2PUC0.71
GUNGUANINEA,B,C,D,E,F,
G,H		1XY30.71
GUNGUANINEA,B,C,D,E,F2O740.71
GUNGUANINEA2PWU0.71
GUNGUANINEA2OOD0.71
GUNGUANINEA2POT0.71
ARP9-HYDROXYPROPYLADENINE, R-ISOMERA,B1E2I0.71
37TTHEOBROMINEA2EFJ0.76
5AC5-amino-1H-imidazole-4-carboxamideA,B3CL80.76
2801-methyl-1H-imidazole-5-carbaldehydeX2RBY0.71
APS9-HYDROXYPROPYLADENINE, S-ISOMERA,B1E2I0.71
2DI9-[(2R,5R)-5-(HYDROXYMETHYL)TETRAHYDROFURAN-
2-YL]-1,9-DIHYDRO-6H-PURIN-6-ONE		E1V3Q0.72
ZGU(S)-1'-(2',3'-DIHYDROXYPROPYL)-
GUANINE		A2JJA0.78
3DG9-(3-DEOXY-BETA-D-RIBOFURANOSYL)GUANINEE1V450.72
XANXANTHINEA3GAO0.7
XANXANTHINE2,3,4,A,B,C,
J,K,L,S,T,U		3EUB0.7
XANXANTHINEA,B,C,D,E,F1YR30.7
XANXANTHINEA2UZ90.7
XANXANTHINEA,B,C,D,E,F,
G,H		2W3S0.7
XANXANTHINEA,B,C,D1A960.7
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