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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03168794

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2BAA3C210.72
2BAA3C1Y0.72
1AP2,6-DIAMINOPURINE NUCLEOTIDEA1S1K0.76
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,B1D760.76
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,M1ZAY0.76
1AP2,6-DIAMINOPURINE NUCLEOTIDEA211D0.76
1AP2,6-DIAMINOPURINE NUCLEOTIDEC,E3C290.76
1AP2,6-DIAMINOPURINE NUCLEOTIDEA210D0.76
2AMADENOSINE-2'-MONOPHOSPHATEA7RNT0.78
2AMADENOSINE-2'-MONOPHOSPHATEA1PGQ0.78
2AMADENOSINE-2'-MONOPHOSPHATEA6RNT0.78
2AMADENOSINE-2'-MONOPHOSPHATEA1RGK0.78
103A,B,C1CUL0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,D,E,H,J3GIJ0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1T7P0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,X2PYL0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1SKR0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL10.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL20.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1TK80.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,H,P1R0A0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B1QSY0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1MQ20.72
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.78
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.78
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.78
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.78
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
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A1Z350.8
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A2PKK0.8
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C,D2ZJ00.8
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C1PK90.8
2FE2'-fluoro-2'-deoxy-1,N6-ethenoadenineE,G3CWU0.71
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,C,E,F486D0.73
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B,R,S1ASZ0.73
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA2TRA0.73
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B1F7U0.73
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATER,S1ASY0.73
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA3TRA0.73
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEB1F7V0.73
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1YFG0.73
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1LUU0.73
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B,C,D1IL20.73
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B1GAG0.72
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		B,C2G2F0.72
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B,C,D,E,F,
G,H		2G1T0.72
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B2GS60.72
112THIOPHOSPHORIC ACID O-((ADENOSYL-
PHOSPHO)PHOSPHO)-S-ACETAMIDYL-DIESTER		A,B,E,F1RQQ0.72
2EGA,B,C3EPG0.71
2EGA,B2HMD0.71
2EGA,B2HMR0.71
2EGA,B,C3EPI0.71
101A,B,C1CS40.76
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		3G4S0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA6TNA0.81
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		3CCS0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1EHZ0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1FIR0.81
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		1VQ40.81
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		1VQ80.81
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		1VQL0.81
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		3CCJ0.81
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		1VQN0.81
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		1VQO0.81
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		3CC70.81
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		2QEX0.81
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		1VQ90.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA4TNA0.81
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		1YJN0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEC,D1MJ10.81
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		1VQ70.81
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		3CC20.81
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		3CD60.81
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		1YHQ0.81
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		3G710.81
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		2OTJ0.81
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		1VQM0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEX,Y2DLC0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B,C,D,E,F1TTT0.81
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		3CCL0.81
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		3CCR0.81
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		1S720.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B1F7U0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA2Z9Q0.81
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		1VQK0.81
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		3CCV0.81
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		1YJW0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA4TRA0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1C2W0.81
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		3CCE0.81
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		3CME0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGO0.81
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		1YIJ0.81
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		2OTL0.81
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		3CC40.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,C,E,F486D0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEE,F1SZ10.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1TN20.81
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		3G6E0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1EVV0.81
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		1YI20.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGP0.81
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		3CCU0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B3DEG0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1F7V0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1YFG0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1TRA0.81
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		1VQP0.81
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		1VQ60.81
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		1YIT0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B,C,D,E1FCW0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGQ0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1ML50.81
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		3CCQ0.81
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		3CMA0.81
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		3CCM0.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1GIX0.81
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		1YJ90.81
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEV,Y,Z3FIC0.81
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		1VQ50.81
2BUA1U6C0.75
2BUA1U6O0.75
2DI9-[(2R,5R)-5-(HYDROXYMETHYL)TETRAHYDROFURAN-
2-YL]-1,9-DIHYDRO-6H-PURIN-6-ONE		E1V3Q0.72
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
26A6N-DIMETHYLADENOSINEA2A9Y0.8
26A6N-DIMETHYLADENOSINEA2A9Z0.8
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,B1OX50.75
102GAMMA-DEOXY-GAMMA-SULFO-GUANOSINE-
5'-TRIPHOSPHATE		A,C3C160.72
102GAMMA-DEOXY-GAMMA-SULFO-GUANOSINE-
5'-TRIPHOSPHATE		A,C3C140.72