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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03303245

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.74
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.74
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.74
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.74
2FE2'-fluoro-2'-deoxy-1,N6-ethenoadenineE,G3CWU0.7
01G12R750.82
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,D,E,H,J3GIJ0.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1T7P0.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,X2PYL0.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1SKR0.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL10.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL20.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1TK80.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,H,P1R0A0.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B1QSY0.7
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1MQ20.7
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,9,A,
B,C,F,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z		3G4S0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA6TNA0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,F,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		3CCS0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1EHZ0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1FIR0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,4,9,A,
B,C,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		1VQ40.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQ80.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQL0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,9,A,
B,C,F,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		3CCJ0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,4,5,
9,A,B,C,D,F,
H,J,K,L,M,N,
O,Q,R,S,T,U,
Y,Z		1VQN0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQO0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,F,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		3CC70.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		2QEX0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQ90.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA4TNA0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		1YJN0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEC,D1MJ10.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,4,9,A,
B,C,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		1VQ70.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		3CC20.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,4,9,A,
B,C,F,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z		3CD60.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,F,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		1YHQ0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,9,A,
B,C,F,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z		3G710.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		2OTJ0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,4,9,
A,B,C,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQM0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEX,Y2DLC0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B,C,D,E,F1TTT0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,F,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		3CCL0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,9,A,
B,C,F,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		3CCR0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		1S720.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B1F7U0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA2Z9Q0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQK0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,F,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		3CCV0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		1YJW0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA4TRA0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1C2W0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,F,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		3CCE0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,6,9,
A,B,C,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		3CME0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGO0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,9,A,
B,C,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		1YIJ0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		2OTL0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,F,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		3CC40.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,C,E,F486D0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEE,F1SZ10.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1TN20.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,9,A,
B,C,F,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		3G6E0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1EVV0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,9,A,
B,C,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		1YI20.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGP0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,F,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		3CCU0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B3DEG0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1F7V0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1YFG0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1TRA0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQP0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,4,5,9,
A,B,C,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z		1VQ60.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,9,A,
B,C,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		1YIT0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B,C,D,E1FCW0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGQ0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1ML50.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,F,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		3CCQ0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,6,9,
A,B,C,D,F,H,
J,K,L,M,N,O,
Q,R,S,T,U,Y,Z		3CMA0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,3,9,A,B,
C,F,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		3CCM0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1GIX0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,9,A,
B,C,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		1YJ90.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEV,Y,Z3FIC0.78
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE0,1,2,3,4,9,
A,B,C,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z		1VQ50.78
101A,B,C1CS40.73
2AMADENOSINE-2'-MONOPHOSPHATEA7RNT0.75
2AMADENOSINE-2'-MONOPHOSPHATEA1PGQ0.75
2AMADENOSINE-2'-MONOPHOSPHATEA6RNT0.75
2AMADENOSINE-2'-MONOPHOSPHATEA1RGK0.75
2DI9-[(2R,5R)-5-(HYDROXYMETHYL)TETRAHYDROFURAN-
2-YL]-1,9-DIHYDRO-6H-PURIN-6-ONE		E1V3Q0.88
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL		A,B,C3GGS0.77
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL		A1Z340.77
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL		A,B,C1PKE0.77
102GAMMA-DEOXY-GAMMA-SULFO-GUANOSINE-
5'-TRIPHOSPHATE		A,C3C160.85
102GAMMA-DEOXY-GAMMA-SULFO-GUANOSINE-
5'-TRIPHOSPHATE		A,C3C140.85
2BUA1U6C0.72
2BUA1U6O0.72
26A6N-DIMETHYLADENOSINEA2A9Y0.76
26A6N-DIMETHYLADENOSINEA2A9Z0.76
2BDA1U6N0.8
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,C,E,F486D0.86
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B,R,S1ASZ0.86
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA2TRA0.86
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B1F7U0.86
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATER,S1ASY0.86
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA3TRA0.86
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEB1F7V0.86
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1YFG0.86
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1LUU0.86
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B,C,D1IL20.86
2EGA,B,C3EPG0.83
2EGA,B2HMD0.83
2EGA,B2HMR0.83
2EGA,B,C3EPI0.83
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B1GAG0.73
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		B,C2G2F0.73
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B,C,D,E,F,
G,H		2G1T0.73
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B2GS60.73
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B,E,F1RQQ0.73
1PRPHOSPHORIC ACID MONO-[5-({[5-CARBAMOYL-
3-(5-PHOSPHONOOXY-5-DEOXY-RIBOFURANOSYL)-
3H-IMIDAZOL-4-YLAMINO]-METHYL}-
AMINO)-2,3,4-TRIHYDROXY-PENTYL] ESTER		A,B1OX50.89
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A1Z350.79
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A2PKK0.79
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C,D2ZJ00.79
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C1PK90.79
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,D2B1G0.91
1AP2,6-DIAMINOPURINE NUCLEOTIDEA1S1K0.73
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,B1D760.73
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,M1ZAY0.73
1AP2,6-DIAMINOPURINE NUCLEOTIDEA211D0.73
1AP2,6-DIAMINOPURINE NUCLEOTIDEC,E3C290.73
1AP2,6-DIAMINOPURINE NUCLEOTIDEA210D0.73