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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03189040

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2BUA1U6C0.81
2BUA1U6O0.81
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A1Z350.85
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A2PKK0.85
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C,D2ZJ00.85
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C1PK90.85
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.84
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.84
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.84
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.84
2BAA3C210.78
2BAA3C1Y0.78
25A5'-O-MONOPHOSPHORYLADENYLYL(2'-
>5')ADENYLYL(2'->5')ADENOSINE		A1WDY0.74
26A6N-DIMETHYLADENOSINEA2A9Y0.86
26A6N-DIMETHYLADENOSINEA2A9Z0.86
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,D,E,H,J3GIJ0.78
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1T7P0.78
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,X2PYL0.78
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1SKR0.78
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL10.78
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL20.78
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1TK80.78
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,H,P1R0A0.78
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B1QSY0.78
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1MQ20.78
1AP2,6-DIAMINOPURINE NUCLEOTIDEA1S1K0.82
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,B1D760.82
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,M1ZAY0.82
1AP2,6-DIAMINOPURINE NUCLEOTIDEA211D0.82
1AP2,6-DIAMINOPURINE NUCLEOTIDEC,E3C290.82
1AP2,6-DIAMINOPURINE NUCLEOTIDEA210D0.82
01KA3BIY0.75
12A2-METHYLTHIO-N6-(AMINOCARBONYL-
L-THREONYL)-ADENOSINE-5'-MONOPHOSPHATE		A1FIR0.79
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		3G4S0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA6TNA0.72
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		3CCS0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1EHZ0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1FIR0.72
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		1VQ40.72
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		1VQ80.72
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		1VQL0.72
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		3CCJ0.72
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		1VQN0.72
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		1VQO0.72
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		3CC70.72
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		2QEX0.72
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		1VQ90.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA4TNA0.72
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		1YJN0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEC,D1MJ10.72
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		1VQ70.72
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		3CC20.72
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		3CD60.72
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		1YHQ0.72
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		3G710.72
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		2OTJ0.72
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		1VQM0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEX,Y2DLC0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B,C,D,E,F1TTT0.72
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		3CCL0.72
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		3CCR0.72
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		1S720.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B1F7U0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA2Z9Q0.72
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		1VQK0.72
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		3CCV0.72
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		1YJW0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA4TRA0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1C2W0.72
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		3CCE0.72
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		3CME0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGO0.72
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		1YIJ0.72
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		2OTL0.72
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		3CC40.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,C,E,F486D0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEE,F1SZ10.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1TN20.72
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		3G6E0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1EVV0.72
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		1YI20.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGP0.72
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		3CCU0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B3DEG0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1F7V0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1YFG0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1TRA0.72
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		1VQP0.72
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		1VQ60.72
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		1YIT0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B,C,D,E1FCW0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGQ0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1ML50.72
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		3CCQ0.72
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		3CMA0.72
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		3CCM0.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1GIX0.72
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		1YJ90.72
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEV,Y,Z3FIC0.72
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		1VQ50.72
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B1GAG0.83
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		B,C2G2F0.83
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B,C,D,E,F,
G,H		2G1T0.83
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B2GS60.83
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B,E,F1RQQ0.83
2AR2'-DEOXYARISTEROMYCIN-5'-PHOSPHATEA1EXL0.73
2AR2'-DEOXYARISTEROMYCIN-5'-PHOSPHATEA,B1FYI0.73
2CP2-CARBOXYPROPYL-COENZYME AA1EF90.77
2CP2-CARBOXYPROPYL-COENZYME AA,B,C,D7REQ0.77
2AMADENOSINE-2'-MONOPHOSPHATEA7RNT0.82
2AMADENOSINE-2'-MONOPHOSPHATEA1PGQ0.82
2AMADENOSINE-2'-MONOPHOSPHATEA6RNT0.82
2AMADENOSINE-2'-MONOPHOSPHATEA1RGK0.82
191PROPIONYL COENZYME AA,B1XNY0.73
101A,B,C1CS40.82
103A,B,C1CUL0.81
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,D2B1G0.72
139A1JN40.72