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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03399217

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HE2HEXAN-1-OLA1ZNE0.85
1DO1-DODECANOLA,Z2CFZ0.72
PE9PENTAN-1-OLA1ZND0.78
OC9OCTAN-1-OLA1ZNH0.72
OC9OCTAN-1-OLA2QHV0.72
HE4HEPTAN-1-OLA1ZNG0.77
1BO1-BUTANOLX1YKY0.7
1BO1-BUTANOLA,B2HUU0.7
1BO1-BUTANOLA2VDG0.7
1BO1-BUTANOLA,B1OOH0.7
1BO1-BUTANOLC,D1OKX0.7
1BO1-BUTANOLA,B3ET20.7
1BO1-BUTANOLA,B3B6X0.7
1BO1-BUTANOLA1G4H0.7
1BO1-BUTANOLA,B2HUF0.7
DEMDECYLOXY-METHANOLA1EK80.71
DE1DECAN-1-OLA1ZNL0.72
CXLCYCLOHEXANOLA,B1HDX0.71
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
HEZHEXANE-1,6-DIOLA,B1X1V0.85
HEZHEXANE-1,6-DIOLA,B,C,D,E,F1M8T0.85
HEZHEXANE-1,6-DIOLA1J7K0.85
HEZHEXANE-1,6-DIOLA2IOR0.85
HEZHEXANE-1,6-DIOLA,D2NY20.85
HEZHEXANE-1,6-DIOLA2NY00.85
HEZHEXANE-1,6-DIOLA,B,C,D3CDO0.85
HEZHEXANE-1,6-DIOLA,B,C,D2NXZ0.85
HEZHEXANE-1,6-DIOLA,D2NY40.85
HEZHEXANE-1,6-DIOLA1P2V0.85
HEZHEXANE-1,6-DIOLA1NHZ0.85
HEZHEXANE-1,6-DIOLA,C,D,E,F,G2HY60.85
HEZHEXANE-1,6-DIOLA2NXY0.85
HEZHEXANE-1,6-DIOLA,B2VYP0.85
HEZHEXANE-1,6-DIOLA,B1JMT0.85
HEZHEXANE-1,6-DIOLA1U3C0.85
HEZHEXANE-1,6-DIOLA,B,C,D3G360.85
HEZHEXANE-1,6-DIOLA,B,C,D3EDC0.85
HEZHEXANE-1,6-DIOLA1QUH0.85
HEZHEXANE-1,6-DIOLA1IN40.85
HEZHEXANE-1,6-DIOLA,B,C,D1WXW0.85
HEZHEXANE-1,6-DIOLA,B3EV10.85
HEZHEXANE-1,6-DIOLA,B,D2WIW0.85
HEZHEXANE-1,6-DIOLA,B,C,D1IBY0.85
HEZHEXANE-1,6-DIOLA1QUD0.85
ODIOCTANE-1,8-DIOLA2DM50.72