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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02813042

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LX1L-XYLULOSE 5-PHOSPHATEA,B1XBZ0.8
LX1L-XYLULOSE 5-PHOSPHATEA,B1Q6R0.8
ALK(1R)-1-[DIHYDROXY(METHOXY)-LAMBDA^5^-
PHOSPHANYL]ETHANOL
A,B,C,D2VJY0.7
PDIPHOSPHORIC ACID MONO-(3-HYDROXY-
PROPYL) ESTER
A,D1NNJ0.77
PDIPHOSPHORIC ACID MONO-(3-HYDROXY-
PROPYL) ESTER
B,C2NPZ0.77
PDIPHOSPHORIC ACID MONO-(3-HYDROXY-
PROPYL) ESTER
A,D1PJI0.77
PDIPHOSPHORIC ACID MONO-(3-HYDROXY-
PROPYL) ESTER
A,B,D,G1KFV0.77
PDIPHOSPHORIC ACID MONO-(3-HYDROXY-
PROPYL) ESTER
B1EJZ0.77
MIPMONOISOPROPYL ESTER PHOSPHONIC ACIDA1NTP0.86
MIPMONOISOPROPYL ESTER PHOSPHONIC ACIDA1XLU0.86
MIPMONOISOPROPYL ESTER PHOSPHONIC ACIDA,B1O6E0.86
PEQL-PHOSPHOLACTATEA,B,C,D,E,F,
G,H
1AQF0.7
PEQL-PHOSPHOLACTATEA,B3FJ70.7
CDI2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATEA1KNJ0.7
CDI2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATEA,B,C,D,E,F,
G,H
1H480.7
CDI2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATEA1JY80.7
G3PSN-GLYCEROL-3-PHOSPHATEA,B1Y380.9
G3PSN-GLYCEROL-3-PHOSPHATEA,B1WBJ0.9
G3PSN-GLYCEROL-3-PHOSPHATEB6TIM0.9
G3PSN-GLYCEROL-3-PHOSPHATEA3EKZ0.9
G3PSN-GLYCEROL-3-PHOSPHATEA,B2TSY0.9
G3PSN-GLYCEROL-3-PHOSPHATEA,B1Z820.9
G3PSN-GLYCEROL-3-PHOSPHATEA,B,C,D1IXN0.9
G3PSN-GLYCEROL-3-PHOSPHATEA,B1DC40.9
G3PSN-GLYCEROL-3-PHOSPHATEA,B,C,D1IXO0.9
G3PSN-GLYCEROL-3-PHOSPHATEA,B,C,D1FDJ0.9
G3PSN-GLYCEROL-3-PHOSPHATEA,B2J9X0.9
G3PSN-GLYCEROL-3-PHOSPHATEA,B,C,D1QI10.9
G3PSN-GLYCEROL-3-PHOSPHATEA,B1OF80.9
DIIMETHYLPHOSPHONIC ACID DIISOPROPYL ESTERA,B1P6C0.71
DIIMETHYLPHOSPHONIC ACID DIISOPROPYL ESTERA,B1EZ20.71
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,B,C3BBK0.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,B,C3BBI0.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,B,C3GS80.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,C3GS50.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,B,C3B910.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,B3B5A0.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,B,C2P7E0.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,B,C3B580.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,B,C,D3GS10.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEB,C3B5F0.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,B,D2P7D0.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,B,C3B5S0.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,C2NPY0.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEB3CQS0.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,B3CR10.75
S9L2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATEA,B,C3BBM0.75
LXPL-XYLITOL 5-PHOSPHATEA,B1Q6Q0.73
GG6[(1S,2S)-1,2-DIHYDROXYPROPYL]PHOSPHONIC ACIDA,B,C,D,E,F2P7Q0.87
GG6[(1S,2S)-1,2-DIHYDROXYPROPYL]PHOSPHONIC ACIDA2RL20.87
PGRR-1,2-PROPANEDIOLA,B3BXP0.72
PGRR-1,2-PROPANEDIOLA,B,C,P1HHZ0.72
PGRR-1,2-PROPANEDIOLA2PC00.72
PGRR-1,2-PROPANEDIOLA,B,C3GDH0.72
PGRR-1,2-PROPANEDIOLA2VBK0.72
PGRR-1,2-PROPANEDIOLA,B1HQS0.72
PGRR-1,2-PROPANEDIOLA1YIQ0.72
PGRR-1,2-PROPANEDIOLA3EO70.72
PGRR-1,2-PROPANEDIOLA1REM0.72
PGRR-1,2-PROPANEDIOLA2V2B0.72
PGRR-1,2-PROPANEDIOLA,B,E,L1UC50.72
PGRR-1,2-PROPANEDIOLA2HB40.72
2DB(S)-(2,3-DIHYDROXYPROPOXY)TRIHYDROXYBORATEA2ID80.7
DFPDIISOPROPYL PHOSPHONATEA1RS00.76
DFPDIISOPROPYL PHOSPHONATEA,B1DFP0.76
DFPDIISOPROPYL PHOSPHONATEA,B3F9C0.76
DFPDIISOPROPYL PHOSPHONATEA2GZS0.76
DFPDIISOPROPYL PHOSPHONATEA1DUI0.76
DFPDIISOPROPYL PHOSPHONATEA1SUE0.76
DFPDIISOPROPYL PHOSPHONATEA,B1CI90.76
DFPDIISOPROPYL PHOSPHONATEA,B1TKR0.76
DFPDIISOPROPYL PHOSPHONATEA,B1XZK0.76
DFPDIISOPROPYL PHOSPHONATEA2TGD0.76
DFPDIISOPROPYL PHOSPHONATEA,C1P8V0.76
DFPDIISOPROPYL PHOSPHONATEA,B1AT30.76
1GPSN-GLYCEROL-1-PHOSPHATEA,B2F6X0.9
1GPSN-GLYCEROL-1-PHOSPHATEA,B,C,D2VYV0.9
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B1M7P0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEA,C,O,Q1NQO0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B1UOD0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B2OKG0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B3CEP0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B2CLK0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B,C,D3CIF0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEA1UXU0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEF,G1GLC0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEO,P,Q,R3CMC0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEF,G1GLE0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B,C,D1QI10.7
G3HGLYCERALDEHYDE-3-PHOSPHATEG1GLD0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B,C,D2ESD0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B1C7Z0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEO,P,Q,R1NQA0.7
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B,C,D2QE00.7
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B1Z820.7
PGOS-1,2-PROPANEDIOLA2Z3V0.72
PGOS-1,2-PROPANEDIOLA,B1WOM0.72
PGOS-1,2-PROPANEDIOLA,B,E,L1DIO0.72
PGOS-1,2-PROPANEDIOLA,B1R9E0.72
PGOS-1,2-PROPANEDIOLA,B,C,D2PJM0.72
PGOS-1,2-PROPANEDIOLA,L1EGM0.72
PGOS-1,2-PROPANEDIOLA1K6E0.72
PGOS-1,2-PROPANEDIOLA2RIL0.72
PGOS-1,2-PROPANEDIOLA,B,C3GDH0.72
PGOS-1,2-PROPANEDIOLA,B1EX00.72
PGOS-1,2-PROPANEDIOLA,B,C,D,E,F,
G,H
2OIF0.72
PGOS-1,2-PROPANEDIOLA,B3BXP0.72
PGOS-1,2-PROPANEDIOLA,B2EWG0.72
PGOS-1,2-PROPANEDIOLA,L1EGV0.72
PGOS-1,2-PROPANEDIOLA2IZS0.72
PGOS-1,2-PROPANEDIOLA,B,C,D2V9N0.72
PGOS-1,2-PROPANEDIOLA,B,N,P1HHY0.72
PGOS-1,2-PROPANEDIOLA,B2J1P0.72
PGOS-1,2-PROPANEDIOLA2V9L0.72
PGOS-1,2-PROPANEDIOLA,B1RRM0.72
PGOS-1,2-PROPANEDIOLA,B3BF50.72
PGOS-1,2-PROPANEDIOLA1DS10.72
PGOS-1,2-PROPANEDIOLA,B2VZ60.72
PGOS-1,2-PROPANEDIOLA,B1HQS0.72
PGOS-1,2-PROPANEDIOLA2ODV0.72
PGOS-1,2-PROPANEDIOLA,B,E,L1IWP0.72
PGOS-1,2-PROPANEDIOLA,B3BEM0.72
PGOS-1,2-PROPANEDIOLA,L1EEX0.72
PGOS-1,2-PROPANEDIOLA3BQR0.72
PGOS-1,2-PROPANEDIOLA3D710.72
PGOS-1,2-PROPANEDIOLA,B1EVU0.72
PGOS-1,2-PROPANEDIOLA2IZR0.72
PGOS-1,2-PROPANEDIOLA,B,E,L1UC40.72
PGOS-1,2-PROPANEDIOLA,B2E7Y0.72
EFSETHYL DIHYDROGEN PHOSPHATEA1XLV0.71
EFSETHYL DIHYDROGEN PHOSPHATEA,B1P6B0.71
EFSETHYL DIHYDROGEN PHOSPHATEA,B3CAK0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,E1LWW0.82
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C1ORN0.82
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C1ORP0.82
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,B,C,D,E,F2FCC0.82
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,E1LWV0.82
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C2EA00.82
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,E1HU00.82
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,B,C,D,I,J,
K,L
1K820.82
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C1L1Z0.82
PEDPENTANE-3,4-DIOL-5-PHOSPHATEE1LWY0.82
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,B,D,F2OQ40.82
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,B,C1K3X0.82
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C1K3W0.82
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C2OPF0.82
G2H2-HYDROXY-1-(HYDROXYMETHYL)ETHYL DIHYDROGEN PHOSPHATEA,B,C,D1WOA0.9
R5PRIBOSE-5-PHOSPHATEA,B,C,D1U9Z0.73
R5PRIBOSE-5-PHOSPHATEA1V8T0.73
R5PRIBOSE-5-PHOSPHATEA,B1ZHA0.73
R5PRIBOSE-5-PHOSPHATEA,B1ZJI0.73
R5PRIBOSE-5-PHOSPHATEA,B1JCY0.73
R5PRIBOSE-5-PHOSPHATEA,B2R5N0.73
GP9(2R)-2,3-dihydroxypropyl phosphateA2W5S0.87
GP9(2R)-2,3-dihydroxypropyl phosphateA2W5R0.87
GP9(2R)-2,3-dihydroxypropyl phosphateA2W5T0.87
P22ETHYL DIHYDROGEN DIPHOSPHATEA1YBH0.72
P22ETHYL DIHYDROGEN DIPHOSPHATEA1YHZ0.72
P22ETHYL DIHYDROGEN DIPHOSPHATEA1YI10.72
P22ETHYL DIHYDROGEN DIPHOSPHATEA,B,C,D1T9D0.72
P22ETHYL DIHYDROGEN DIPHOSPHATEA1YI00.72
P22ETHYL DIHYDROGEN DIPHOSPHATEA1YHY0.72
P22ETHYL DIHYDROGEN DIPHOSPHATEA,B1T9B0.72
P22ETHYL DIHYDROGEN DIPHOSPHATEA,B1T9C0.72
DX5D-XYLITOL-5-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
2FLI0.73
DPFDIETHYL HYDROGEN PHOSPHATEA2R1M0.72
DPFDIETHYL HYDROGEN PHOSPHATEA2R1K0.72
DPFDIETHYL HYDROGEN PHOSPHATEA,B3CAK0.72
A5PARABINOSE-5-PHOSPHATEA1UJ60.73
A5PARABINOSE-5-PHOSPHATEA,B1FXQ0.73
A5PARABINOSE-5-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
2NX30.73
A5PARABINOSE-5-PHOSPHATEA,B1LRQ0.73
A5PARABINOSE-5-PHOSPHATEA,B2CXP0.73
A5PARABINOSE-5-PHOSPHATEA,B1T8X0.73
A5PARABINOSE-5-PHOSPHATEA,B2EF90.73
A5PARABINOSE-5-PHOSPHATEA,B1FY60.73
A5PARABINOSE-5-PHOSPHATEA,B2NWS0.73
A5PARABINOSE-5-PHOSPHATEA,B2NXG0.73
A5PARABINOSE-5-PHOSPHATEA,B2A2I0.73
A5PARABINOSE-5-PHOSPHATEA,B1FWW0.73
HPD1-HYDROXY-PENTANE-3,4-DIOL-5-PHOSPHATEA,C1L1T0.75
HPD1-HYDROXY-PENTANE-3,4-DIOL-5-PHOSPHATEA,C1L2D0.75
HPD1-HYDROXY-PENTANE-3,4-DIOL-5-PHOSPHATEA,B1JCJ0.75
HPD1-HYDROXY-PENTANE-3,4-DIOL-5-PHOSPHATEA,B1JCL0.75
HPD1-HYDROXY-PENTANE-3,4-DIOL-5-PHOSPHATEA,B,C1RRS0.75
HPD1-HYDROXY-PENTANE-3,4-DIOL-5-PHOSPHATEA,C1L2C0.75
HPD1-HYDROXY-PENTANE-3,4-DIOL-5-PHOSPHATEA,B,C1VRL0.75
HPD1-HYDROXY-PENTANE-3,4-DIOL-5-PHOSPHATEA,B,C,D1UB30.75
P23PROPYL TRIHYDROGEN DIPHOSPHATEA,B1T9A0.76
P23PROPYL TRIHYDROGEN DIPHOSPHATEA,B1T9C0.76
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
ISPPHOSPHORYLISOPROPANEF,G1GMH0.86
ISPPHOSPHORYLISOPROPANEA1TRY0.86
ISPPHOSPHORYLISOPROPANEA,B1TRN0.86
S0H(S)-2-HYDROXYPROPYLPHOSPHONIC ACIDA,B1ZZB0.83
S0H(S)-2-HYDROXYPROPYLPHOSPHONIC ACIDA,B1ZZ70.83
S0H(S)-2-HYDROXYPROPYLPHOSPHONIC ACIDA,B,C1ZZ80.83