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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00542108

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2FI2'-fluoro-2'-deoxyinosineE,G3CWT0.86
2FI2'-fluoro-2'-deoxyinosineE,G3CWS0.86
01G12R750.81
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,B1OX50.81
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,D2B1G0.82
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		3G4S0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA6TNA0.77
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		3CCS0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1EHZ0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1FIR0.77
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		1VQ40.77
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		1VQ80.77
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		1VQL0.77
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		3CCJ0.77
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		1VQN0.77
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		1VQO0.77
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		3CC70.77
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		2QEX0.77
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		1VQ90.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA4TNA0.77
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		1YJN0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEC,D1MJ10.77
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		1VQ70.77
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		3CC20.77
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		3CD60.77
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		1YHQ0.77
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		3G710.77
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		2OTJ0.77
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		1VQM0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEX,Y2DLC0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B,C,D,E,F1TTT0.77
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		3CCL0.77
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		3CCR0.77
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		1S720.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B1F7U0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA2Z9Q0.77
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		1VQK0.77
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		3CCV0.77
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		1YJW0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA4TRA0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1C2W0.77
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		3CCE0.77
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		3CME0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGO0.77
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		1YIJ0.77
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		2OTL0.77
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		3CC40.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,C,E,F486D0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEE,F1SZ10.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1TN20.77
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		3G6E0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1EVV0.77
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		1YI20.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGP0.77
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		3CCU0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B3DEG0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1F7V0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1YFG0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA1TRA0.77
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		1VQP0.77
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		1VQ60.77
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		1YIT0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEA,B,C,D,E1FCW0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1JGQ0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB1ML50.77
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		3CCQ0.77
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		3CMA0.77
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		3CCM0.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEB,C,D1GIX0.77
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		1YJ90.77
1MA6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATEV,Y,Z3FIC0.77
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		1VQ50.77
2EGA,B,C3EPG0.85
2EGA,B2HMD0.85
2EGA,B2HMR0.85
2EGA,B,C3EPI0.85
2AD2'-AMINO-2'-DEOXYADENOSINEA,D2BTE0.7
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2H0X0.7
2AD2'-AMINO-2'-DEOXYADENOSINEA,B2GCS0.7
2AD2'-AMINO-2'-DEOXYADENOSINEA1OBC0.7
2ND2'-DEOXYINOSINEA1Z390.91
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B,C,D,E1FCW0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B,C,D,E,F1OB50.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEB,C,D1JGQ0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEB1ML50.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEX,Y2DLC0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B,C,D,E,F1TTT0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B1F7U0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA2Z9Q0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEB,C,D1GIX0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1WTS0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B1OB20.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATE2,Y2QNH0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B3DEG0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEC,D1MJ10.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEB1F7V0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1WTT0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1YFG0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1TRA0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,C,E,F486D0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEE,F1SZ10.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1TN20.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1EVV0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATE0,Y,Z2OW80.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEB,C,D1JGP0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA4TNA0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEV,Y,Z3FIC0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA6TNA0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1EHZ0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1FIR0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEA4TRA0.85
2MG2N-METHYLGUANOSINE-5'-MONOPHOSPHATEB,C,D1JGO0.85
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,C,E,F486D0.85
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B,R,S1ASZ0.85
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA2TRA0.85
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B1F7U0.85
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATER,S1ASY0.85
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA3TRA0.85
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEB1F7V0.85
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1YFG0.85
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA1LUU0.85
1MG1N-METHYLGUANOSINE-5'-MONOPHOSPHATEA,B,C,D1IL20.85
2MA2-METHYLADENOSINE-5'-MONOPHOSPHATET1GSG0.75
2MA2-METHYLADENOSINE-5'-MONOPHOSPHATEC,D1EFW0.75
35GGUANOSINE-3',5'-MONOPHOSPHATEA,B3DBA0.85
35GGUANOSINE-3',5'-MONOPHOSPHATEA,B2OUU0.85
35GGUANOSINE-3',5'-MONOPHOSPHATEA,B,C,D,E,F1BHN0.85
35GGUANOSINE-3',5'-MONOPHOSPHATEA2K310.85
102GAMMA-DEOXY-GAMMA-SULFO-GUANOSINE-
5'-TRIPHOSPHATE		A,C3C160.84
102GAMMA-DEOXY-GAMMA-SULFO-GUANOSINE-
5'-TRIPHOSPHATE		A,C3C140.84
2DI9-[(2R,5R)-5-(HYDROXYMETHYL)TETRAHYDROFURAN-
2-YL]-1,9-DIHYDRO-6H-PURIN-6-ONE		E1V3Q0.89
2GPGUANOSINE-2'-MONOPHOSPHATEA1FYS0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B1GMP0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1HYF0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA4BU40.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1DET0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B5BIR0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B,C,D1BVI0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1I3F0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B2AAD0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA2BU40.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1RGE0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA5BU40.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1BU40.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B1TRQ0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1HZ10.86
2GPGUANOSINE-2'-MONOPHOSPHATEA3BU40.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B,C,D2HOH0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1I2E0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B1GMR0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA3BIR0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1RGL0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1RNT0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B,C1CH00.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1RHL0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1LRA0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1I2G0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B1BIR0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1G020.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B,C,D4HOH0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1FZU0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B1TRP0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1FUT0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1I2F0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA2BIR0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1I3I0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B,C,D1I0X0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B,C,D3HOH0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA,B,C,D5HOH0.86
2GPGUANOSINE-2'-MONOPHOSPHATEA1I0V0.86
2BDA1U6N0.8
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A1Z350.71
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A2PKK0.71
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C,D2ZJ00.71
2FA2-(6-AMINO-2-FLUORO-PURIN-9-YL)-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
3,4-DIOL		A,B,C1PK90.71
2VA2'-(L-VALYL)AMINO-2'-DEOXYADENOSINEA1WNZ0.73
2MDA,B,K,L1H0H0.73
2MDA1TMO0.73
2MDX2IV20.73
3AD3'-DEOXYADENOSINEA,B3B4B0.7
3AD3'-DEOXYADENOSINEA,B3B4C0.7
3AD3'-DEOXYADENOSINEA,B1FA00.7