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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03305394

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HFPALPHA-HYDROXYFARNESYLPHOSPHONIC ACIDA,B,P1QBQ0.73
HFPALPHA-HYDROXYFARNESYLPHOSPHONIC ACIDB1N9A0.73
HFPALPHA-HYDROXYFARNESYLPHOSPHONIC ACIDA,B1N940.73
HFPALPHA-HYDROXYFARNESYLPHOSPHONIC ACIDB1N950.73
HFPALPHA-HYDROXYFARNESYLPHOSPHONIC ACIDB1NI10.73
HFPALPHA-HYDROXYFARNESYLPHOSPHONIC ACIDB1NL40.73
L4P3-[GLYCEROLYLPHOSPHONYL]-[1,2-DI-
PHYTANYL]GLYCEROL		A1DZE0.72
L4P3-[GLYCEROLYLPHOSPHONYL]-[1,2-DI-
PHYTANYL]GLYCEROL		A1QM80.72
1DO1-DODECANOLA,Z2CFZ0.72
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1O0A0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A2I200.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1F4Z0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1F500.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1M0K0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1P8I0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1JV70.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1JV60.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1M0L0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1P8U0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A2I1X0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1KG80.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A2I210.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1P8H0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1C8R0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1M0M0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1MGY0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1KG90.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1S8J0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1C3W0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1KGB0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1C8S0.85
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL		A1S8L0.85
ARC3,7,11,15-TETRAMETHYL-HEXADECAN-
1-OL		A,B,C1BRR0.83
OC9OCTAN-1-OLA1ZNH0.72
OC9OCTAN-1-OLA2QHV0.72
DE1DECAN-1-OLA1ZNL0.72
HND(4S)-nonane-1,4-diolA2KAR0.78
HND(4S)-nonane-1,4-diolA2KAS0.78
MHN6-METHYLHEPTAN-1-OLA,B1OYF0.82
F09NONAN-1-OLA,C2DWD0.72
F09NONAN-1-OLB,C1R3L0.72
F09NONAN-1-OLC,H1R3I0.72
F09NONAN-1-OLA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V		1YCE0.72
F09NONAN-1-OLC2DWE0.72
F09NONAN-1-OLA,C2HVJ0.72
F09NONAN-1-OLB,C1R3J0.72
F09NONAN-1-OLC1K4D0.72
F09NONAN-1-OLA,C1K4C0.72
F09NONAN-1-OLC2ATK0.72
F09NONAN-1-OLA,C1ZWI0.72
F09NONAN-1-OLA1ZNK0.72
F09NONAN-1-OLB,C1S5H0.72
F09NONAN-1-OLA,C2HVK0.72
F09NONAN-1-OLA,C2P7T0.72
ODIOCTANE-1,8-DIOLA2DM50.72
L2P2,3-DI-PHYTANYL-GLYCEROLA1QM80.85
L2P2,3-DI-PHYTANYL-GLYCEROLA1UCQ0.85
L2P2,3-DI-PHYTANYL-GLYCEROLA2ZFE0.85
L2P2,3-DI-PHYTANYL-GLYCEROLA2EI40.85
L2P2,3-DI-PHYTANYL-GLYCEROLA1IW90.85
L2P2,3-DI-PHYTANYL-GLYCEROLA1IXF0.85
L2P2,3-DI-PHYTANYL-GLYCEROLA,B,D,E2Z550.85
L2P2,3-DI-PHYTANYL-GLYCEROL11X0K0.85
L2P2,3-DI-PHYTANYL-GLYCEROLA1X0S0.85
L2P2,3-DI-PHYTANYL-GLYCEROL11X0I0.85
L2P2,3-DI-PHYTANYL-GLYCEROLA1DZE0.85
L2P2,3-DI-PHYTANYL-GLYCEROLA1IW60.85
YLL(1R,2S,3S,4S,5R,6R)-6-(HYDROXYMETHYL)CYCLOHEXANE-
1,2,3,4,5-PENTOL		A,B2JAL0.72
PH11,2-[DI-2,6,10,14-TETRAMETHYL-HEXADECAN-
16-OXY]-PROPANE		A1QHJ0.76
HTOHEPTANE-1,2,3-TRIOLH,L,M2HH10.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWT0.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXK0.78
HTOHEPTANE-1,2,3-TRIOLH,L,M1RZH0.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2HG30.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX30.78
HTOHEPTANE-1,2,3-TRIOLA2PIL0.78
HTOHEPTANE-1,2,3-TRIOLA,B1U190.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2J8D0.78
HTOHEPTANE-1,2,3-TRIOLA,B,C,D3DTU0.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX40.78
HTOHEPTANE-1,2,3-TRIOLA,B1HZX0.78
HTOHEPTANE-1,2,3-TRIOLA,B2G870.78
HTOHEPTANE-1,2,3-TRIOLA,B2PED0.78
HTOHEPTANE-1,2,3-TRIOLC,H,L,M3D380.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWV0.78
HTOHEPTANE-1,2,3-TRIOLH,L,M1RG50.78
HTOHEPTANE-1,2,3-TRIOLA1KMO0.78
HTOHEPTANE-1,2,3-TRIOLC,H,L,M1L9B0.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWU0.78
HTOHEPTANE-1,2,3-TRIOLA1AY20.78
HTOHEPTANE-1,2,3-TRIOLA,B1RP00.78
HTOHEPTANE-1,2,3-TRIOLC,H,L,M2I5N0.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2J8C0.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2HJ60.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXJ0.78
HTOHEPTANE-1,2,3-TRIOLL,M1YF60.78
HTOHEPTANE-1,2,3-TRIOLB2BF30.78
HTOHEPTANE-1,2,3-TRIOLA,B2HPY0.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX50.78
HTOHEPTANE-1,2,3-TRIOLL,M,X2UXM0.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXL0.78
HTOHEPTANE-1,2,3-TRIOLA,B1L9H0.78
HTOHEPTANE-1,2,3-TRIOLA2HI20.78
HTOHEPTANE-1,2,3-TRIOLA,B,D,E,G,H,
J,K		1LGH0.78
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWW0.78
5HD5-(2-hydroxyethyl)nonane-1,9-diolA3DWB0.83