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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03079400

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PH22-AMINO-6-HYDROXYMETHYL-7,8-DIHYDRO-
3H-PTERIDIN-4-ONE
A1Q0N0.73
PH22-AMINO-6-HYDROXYMETHYL-7,8-DIHYDRO-
3H-PTERIDIN-4-ONE
A,B1RU10.73
PH22-AMINO-6-HYDROXYMETHYL-7,8-DIHYDRO-
3H-PTERIDIN-4-ONE
A1HQ20.73
PH22-AMINO-6-HYDROXYMETHYL-7,8-DIHYDRO-
3H-PTERIDIN-4-ONE
A,B2QX00.73
PH22-AMINO-6-HYDROXYMETHYL-7,8-DIHYDRO-
3H-PTERIDIN-4-ONE
A1F9H0.73
PH22-AMINO-6-HYDROXYMETHYL-7,8-DIHYDRO-
3H-PTERIDIN-4-ONE
A1AJ00.73
PH22-AMINO-6-HYDROXYMETHYL-7,8-DIHYDRO-
3H-PTERIDIN-4-ONE
A,B,C,D,E,F,
G,H
1NBU0.73
PH22-AMINO-6-HYDROXYMETHYL-7,8-DIHYDRO-
3H-PTERIDIN-4-ONE
A2DHN0.73
BHS6S-5,6,7,8-TETRAHYDROBIOPTERINA,B1DMI0.96
LMZ5-NITROSO-6-RIBITYL-AMINO-2,4(1H,3H)-
PYRIMIDINEDIONE
A,B,C,D,E,F,
G,H,I,J
1C410.72
LMZ5-NITROSO-6-RIBITYL-AMINO-2,4(1H,3H)-
PYRIMIDINEDIONE
A,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T
1C2Y0.72
LMZ5-NITROSO-6-RIBITYL-AMINO-2,4(1H,3H)-
PYRIMIDINEDIONE
A,B,C,D,E2A590.72
LMZ5-NITROSO-6-RIBITYL-AMINO-2,4(1H,3H)-
PYRIMIDINEDIONE
A,B,C,D,E1NQV0.72
HBI7,8-DIHYDROBIOPTERINA,B,C,D2BF70.84
HBI7,8-DIHYDROBIOPTERINA,B3E7T0.84
HBI7,8-DIHYDROBIOPTERINA1DR40.84
HBI7,8-DIHYDROBIOPTERINA1DMW0.84
HBI7,8-DIHYDROBIOPTERINA,B2FC20.84
HBI7,8-DIHYDROBIOPTERINA1DR60.84
HBI7,8-DIHYDROBIOPTERINA,B,C,D,E,F,
G,H
1DCP0.84
HBI7,8-DIHYDROBIOPTERINA,B2G6I0.84
HBI7,8-DIHYDROBIOPTERINA1DR30.84
HBI7,8-DIHYDROBIOPTERINA,B,C,D1E920.84
HBI7,8-DIHYDROBIOPTERINA2BHJ0.84
HBI7,8-DIHYDROBIOPTERINA,B2G6L0.84
HBI7,8-DIHYDROBIOPTERINA2TOH0.84
HBI7,8-DIHYDROBIOPTERINA1LRM0.84
HBI7,8-DIHYDROBIOPTERINA,B1JWK0.84
HBI7,8-DIHYDROBIOPTERINA1DR10.84
HBI7,8-DIHYDROBIOPTERINA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T
1WPL0.84
HBI7,8-DIHYDROBIOPTERINA,B2G6N0.84
HBI7,8-DIHYDROBIOPTERINA1LTZ0.84
HBI7,8-DIHYDROBIOPTERINA1MLW0.84
HBI7,8-DIHYDROBIOPTERINA2FC10.84
NPR2-AMINO-7,8-DIHYDRO-6-(1,2,3-TRIHYDROXYPROPYL)-
4(1H)-PTERIDINONE
A1U680.81
MPNPHOSPHORIC ACID MONO-(2-AMINO-4-
OXO-5,6-DITHIOXO-1,5,6,7,8A,9,10,10A-
OCTAHYDRO-4H-8-OXA-1,3,9,10-TETRAAZA-
ANTHRACEN-7-YLMETHYL) ESTER
A,B,C,D,E,F,
G,H
1JRP0.71
MPNPHOSPHORIC ACID MONO-(2-AMINO-4-
OXO-5,6-DITHIOXO-1,5,6,7,8A,9,10,10A-
OCTAHYDRO-4H-8-OXA-1,3,9,10-TETRAAZA-
ANTHRACEN-7-YLMETHYL) ESTER
A,B,C,D,E,F,
G,H
2W550.71
MPNPHOSPHORIC ACID MONO-(2-AMINO-4-
OXO-5,6-DITHIOXO-1,5,6,7,8A,9,10,10A-
OCTAHYDRO-4H-8-OXA-1,3,9,10-TETRAAZA-
ANTHRACEN-7-YLMETHYL) ESTER
A,B,C,D,E,F,
G,H
2W540.71
MPNPHOSPHORIC ACID MONO-(2-AMINO-4-
OXO-5,6-DITHIOXO-1,5,6,7,8A,9,10,10A-
OCTAHYDRO-4H-8-OXA-1,3,9,10-TETRAAZA-
ANTHRACEN-7-YLMETHYL) ESTER
A,B,C,D,E,F,
G,H
2W3S0.71
MPNPHOSPHORIC ACID MONO-(2-AMINO-4-
OXO-5,6-DITHIOXO-1,5,6,7,8A,9,10,10A-
OCTAHYDRO-4H-8-OXA-1,3,9,10-TETRAAZA-
ANTHRACEN-7-YLMETHYL) ESTER
A,B,C,D,E,F,
G,H
1JRO0.71
MPNPHOSPHORIC ACID MONO-(2-AMINO-4-
OXO-5,6-DITHIOXO-1,5,6,7,8A,9,10,10A-
OCTAHYDRO-4H-8-OXA-1,3,9,10-TETRAAZA-
ANTHRACEN-7-YLMETHYL) ESTER
A,B,C,D,E,F,
G,H
2W3R0.71
ZZZ6-FORMYLTETRAHYDROPTERINA2CFI0.71
H2B2-AMINO-6-(1,2-DIHYDROXY-PROPYL)-
7,8-DIHYDRO-6H-PTERIDIN-4-ONE
A,B,C,D4NOS0.77
H2B2-AMINO-6-(1,2-DIHYDROXY-PROPYL)-
7,8-DIHYDRO-6H-PTERIDIN-4-ONE
A1TG20.77
H2B2-AMINO-6-(1,2-DIHYDROXY-PROPYL)-
7,8-DIHYDRO-6H-PTERIDIN-4-ONE
A,B1DWW0.77
H2B2-AMINO-6-(1,2-DIHYDROXY-PROPYL)-
7,8-DIHYDRO-6H-PTERIDIN-4-ONE
X2FBZ0.77
H2B2-AMINO-6-(1,2-DIHYDROXY-PROPYL)-
7,8-DIHYDRO-6H-PTERIDIN-4-ONE
A,B2V6T0.77
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1K2U0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA1KW00.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1QW50.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3B3M0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1ZZR0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1ZZT0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3E6N0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3DWJ0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA1QW60.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1LZX0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3E7M0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1P6H0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B,C,D3E7G0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1P6K0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1ZVL0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1M8I0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3NOS0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1K2S0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1DM80.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1NSE0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA1J8U0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1MMV0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1M8H0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3E6O0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B,C,D,E,F2DTT0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B2HX20.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1RS90.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1MMW0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3B3N0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1D1X0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1P6N0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3E7I0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B,C,D4NOS0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1D1V0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1N2N0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B2HX30.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3NOD0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B,C,D2NSI0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1K2R0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1ZZS0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3DQR0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1DF10.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1R350.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1RS80.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA1VAG0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1JWJ0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1VAF0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3E6L0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B9NSE0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3B3O0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B2G6H0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1QW40.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1ZZU0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA1MMT0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1P6M0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1P6J0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3DQT0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1RS70.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B2G6M0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1QOM0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1LZZ0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B,C,D3EJ80.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B,C,D1NSI0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA2AN20.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA1QWC0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3B3P0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B2G6K0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B2NOD0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1M000.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA1MMK0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1M9T0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1NOD0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA1ZVI0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3E670.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3E680.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1Q2O0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1K2T0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1M8D0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1OM40.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B8NSE0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1DWX0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3EAI0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B2NSE0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3EBD0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1ZZQ0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B,C,D2BFP0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1OM50.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1D1W0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1P6L0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3DQS0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1RS60.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1M8E0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1P6I0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3E650.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3E6T0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B1FOP0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B3EBF0.96
H4B5,6,7,8-TETRAHYDROBIOPTERINA,B2HX40.96
RDL6,7-DIOXO-5H-8-RIBITYLAMINOLUMAZINEA,B,C,D,E2B990.74
RDL6,7-DIOXO-5H-8-RIBITYLAMINOLUMAZINEA,B,C,D,E1NQU0.74