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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02364603

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BU11,4-BUTANEDIOLA2BAB0.87
BU11,4-BUTANEDIOLA,B2HW80.87
BU11,4-BUTANEDIOLA2B9Y0.87
BU11,4-BUTANEDIOLA1M8R0.87
BU11,4-BUTANEDIOLA,B,C3FNK0.87
BU11,4-BUTANEDIOLA,B1TZP0.87
BU11,4-BUTANEDIOLA1M8S0.87
BU11,4-BUTANEDIOLA1VIO0.87
BU11,4-BUTANEDIOLA2W620.87
BU11,4-BUTANEDIOLA2RH10.87
BU11,4-BUTANEDIOLA,B,C3CED0.87
BU11,4-BUTANEDIOLA1BK90.87
BU11,4-BUTANEDIOLA1X9D0.87
PG02-(2-METHOXYETHOXY)ETHANOLA,B3CN90.73
PG02-(2-METHOXYETHOXY)ETHANOLA2GLA0.73
PG02-(2-METHOXYETHOXY)ETHANOLA2VJI0.73
PG02-(2-METHOXYETHOXY)ETHANOLA2CU90.73
BU21,3-BUTANEDIOLA,B1LOL0.77
BU21,3-BUTANEDIOLA,B2RFM0.77
POLN-PROPANOLA,B1AL40.74
POLN-PROPANOLA2Q1P0.74
POLN-PROPANOLA,B,C,D,E3DWQ0.74
POLN-PROPANOLA1JSE0.74
POLN-PROPANOLA,B1OOG0.74
POLN-PROPANOLA,B3CL10.74
HE2HEXAN-1-OLA1ZNE0.7
AE32-(2-ETHOXYETHOXY)ETHANOLA,B2C2N0.73
AE32-(2-ETHOXYETHOXY)ETHANOLA,B2JGH0.73
AE32-(2-ETHOXYETHOXY)ETHANOLA,B2JGJ0.73
AE32-(2-ETHOXYETHOXY)ETHANOLA,B,C2JHE0.73
AE32-(2-ETHOXYETHOXY)ETHANOLA,B1J060.73
AE32-(2-ETHOXYETHOXY)ETHANOLA,B2JGI0.73
ETX2-ETHOXYETHANOLA,B2D1G0.73
ETX2-ETHOXYETHANOLA3BBY0.73
ETX2-ETHOXYETHANOLA,B1R370.73
ETX2-ETHOXYETHANOLA,B,C,D2VZY0.73
ETX2-ETHOXYETHANOLA,H,L,U2FD60.73
ETX2-ETHOXYETHANOLA2GNO0.73
ETX2-ETHOXYETHANOLA,B,H3GBN0.73
ETX2-ETHOXYETHANOLA,B3DT70.73
ETX2-ETHOXYETHANOLA,B2R7H0.73
ETX2-ETHOXYETHANOLA2HX50.73
ETX2-ETHOXYETHANOLA,B,C,D3E490.73
ETX2-ETHOXYETHANOLA,C3BYB0.73
HEZHEXANE-1,6-DIOLA,B1X1V0.7
HEZHEXANE-1,6-DIOLA,B,C,D,E,F1M8T0.7
HEZHEXANE-1,6-DIOLA1J7K0.7
HEZHEXANE-1,6-DIOLA2IOR0.7
HEZHEXANE-1,6-DIOLA,D2NY20.7
HEZHEXANE-1,6-DIOLA2NY00.7
HEZHEXANE-1,6-DIOLA,B,C,D3CDO0.7
HEZHEXANE-1,6-DIOLA,B,C,D2NXZ0.7
HEZHEXANE-1,6-DIOLA,D2NY40.7
HEZHEXANE-1,6-DIOLA1P2V0.7
HEZHEXANE-1,6-DIOLA1NHZ0.7
HEZHEXANE-1,6-DIOLA,C,D,E,F,G2HY60.7
HEZHEXANE-1,6-DIOLA2NXY0.7
HEZHEXANE-1,6-DIOLA,B2VYP0.7
HEZHEXANE-1,6-DIOLA,B1JMT0.7
HEZHEXANE-1,6-DIOLA1U3C0.7
HEZHEXANE-1,6-DIOLA,B,C,D3G360.7
HEZHEXANE-1,6-DIOLA,B,C,D3EDC0.7
HEZHEXANE-1,6-DIOLA1QUH0.7
HEZHEXANE-1,6-DIOLA1IN40.7
HEZHEXANE-1,6-DIOLA,B,C,D1WXW0.7
HEZHEXANE-1,6-DIOLA,B3EV10.7
HEZHEXANE-1,6-DIOLA,B,D2WIW0.7
HEZHEXANE-1,6-DIOLA,B,C,D1IBY0.7
HEZHEXANE-1,6-DIOLA1QUD0.7
1BO1-BUTANOLX1YKY0.83
1BO1-BUTANOLA,B2HUU0.83
1BO1-BUTANOLA2VDG0.83
1BO1-BUTANOLA,B1OOH0.83
1BO1-BUTANOLC,D1OKX0.83
1BO1-BUTANOLA,B3ET20.83
1BO1-BUTANOLA,B3B6X0.83
1BO1-BUTANOLA1G4H0.83
1BO1-BUTANOLA,B2HUF0.83
IP31-HYDROXY-3-METHYLBUTANEA,B1HRN0.73
IP31-HYDROXY-3-METHYLBUTANEA,B1BIL0.73
PE9PENTAN-1-OLA1ZND0.76
BU3(R,R)-2,3-BUTANEDIOLA,B2CL50.7
BU3(R,R)-2,3-BUTANEDIOLA1Z2U0.7
BU3(R,R)-2,3-BUTANEDIOLA,B1SMH0.7
BU3(R,R)-2,3-BUTANEDIOLA1XH90.7
BU3(R,R)-2,3-BUTANEDIOLA,B,C,D,E,F,
G,H
2F9P0.7
BU3(R,R)-2,3-BUTANEDIOLA2H900.7
BU3(R,R)-2,3-BUTANEDIOLA,B,C,D,E,F,
G,H
2F9N0.7
BU3(R,R)-2,3-BUTANEDIOLA,B1XH50.7
PDO1,3-PROPANDIOLA1ZV90.71
PDO1,3-PROPANDIOLA1NAI0.71
PDO1,3-PROPANDIOLF1MR30.71
PDO1,3-PROPANDIOLA,B,C3FNK0.71
PDO1,3-PROPANDIOLA2O2I0.71
PDO1,3-PROPANDIOLA1D070.71
PDO1,3-PROPANDIOLA1IZ80.71
PDO1,3-PROPANDIOLA,H1BTW0.71
SBT2-BUTANOLA,B,C,D1BXZ0.72
SBT2-BUTANOLA2PLH0.72