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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02815037

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2BUA1U6C0.87
2BUA1U6O0.87
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,D,E,H,J3GIJ0.85
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1T7P0.85
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,X2PYL0.85
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1SKR0.85
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL10.85
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL20.85
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1TK80.85
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,H,P1R0A0.85
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B1QSY0.85
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1MQ20.85
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.92
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.92
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.92
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.92
26A6N-DIMETHYLADENOSINEA2A9Y0.91
26A6N-DIMETHYLADENOSINEA2A9Z0.91
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL		A,B,C3GGS0.92
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL		A1Z340.92
2FD5-(6-AMINO-2-FLUORO-PURIN-9-YL)-
2-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3-OL		A,B,C1PKE0.92
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A1Z350.92
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A2PKK0.92
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C,D2ZJ00.92
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C1PK90.92
25A5'-O-MONOPHOSPHORYLADENYLYL(2'-
>5')ADENYLYL(2'->5')ADENOSINE		A1WDY0.78
2DI9-[(2R,5R)-5-(HYDROXYMETHYL)TETRAHYDROFURAN-
2-YL]-1,9-DIHYDRO-6H-PURIN-6-ONE		E1V3Q0.71
101A,B,C1CS40.89
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B1GAG0.82
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		B,C2G2F0.82
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B,C,D,E,F,
G,H		2G1T0.82
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B2GS60.82
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B,E,F1RQQ0.82
12A2-METHYLTHIO-N6-(AMINOCARBONYL-
L-THREONYL)-ADENOSINE-5'-MONOPHOSPHATE		A1FIR0.74
1DA1-DEAZA-ADENOSINEA1ADD0.72
139A1JN40.75
103A,B,C1CUL0.87
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		3G4S0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA6TNA0.76
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		3CCS0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1EHZ0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1FIR0.76
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		1VQ40.76
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		1VQ80.76
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		1VQL0.76
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		3CCJ0.76
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		1VQN0.76
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		1VQO0.76
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		3CC70.76
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		2QEX0.76
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		1VQ90.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA4TNA0.76
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		1YJN0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEC,D1MJ10.76
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		1VQ70.76
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		3CC20.76
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		3CD60.76
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		1YHQ0.76
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		3G710.76
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		2OTJ0.76
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		1VQM0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEX,Y2DLC0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B,C,D,E,F1TTT0.76
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		3CCL0.76
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		3CCR0.76
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		1S720.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B1F7U0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA2Z9Q0.76
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		1VQK0.76
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		3CCV0.76
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		1YJW0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA4TRA0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1C2W0.76
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		3CCE0.76
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		3CME0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGO0.76
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		1YIJ0.76
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		2OTL0.76
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		3CC40.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,C,E,F486D0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEE,F1SZ10.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1TN20.76
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		3G6E0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1EVV0.76
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		1YI20.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGP0.76
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		3CCU0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B3DEG0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1F7V0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1YFG0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1TRA0.76
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		1VQP0.76
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		1VQ60.76
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		1YIT0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B,C,D,E1FCW0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGQ0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1ML50.76
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		3CCQ0.76
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		3CMA0.76
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		3CCM0.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1GIX0.76
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		1YJ90.76
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEV,Y,Z3FIC0.76
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		1VQ50.76
2BAA3C210.82
2BAA3C1Y0.82
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,D2B1G0.77
2AMADENOSINE-2'-MONOPHOSPHATEA7RNT0.9
2AMADENOSINE-2'-MONOPHOSPHATEA1PGQ0.9
2AMADENOSINE-2'-MONOPHOSPHATEA6RNT0.9
2AMADENOSINE-2'-MONOPHOSPHATEA1RGK0.9
2AR2'-DEOXYARISTEROMYCIN-5'-PHOSPHATEA1EXL0.78
2AR2'-DEOXYARISTEROMYCIN-5'-PHOSPHATEA,B1FYI0.78
1AP2,6-DIAMINOPURINE NUCLEOTIDEA1S1K0.89
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,B1D760.89
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,M1ZAY0.89
1AP2,6-DIAMINOPURINE NUCLEOTIDEA211D0.89
1AP2,6-DIAMINOPURINE NUCLEOTIDEC,E3C290.89
1AP2,6-DIAMINOPURINE NUCLEOTIDEA210D0.89