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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02862834

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HE2HEXAN-1-OLA1ZNE0.73
MHN6-METHYLHEPTAN-1-OLA,B1OYF0.74
HND(4S)-nonane-1,4-diolA2KAR0.79
HND(4S)-nonane-1,4-diolA2KAS0.79
ARC3,7,11,15-TETRAMETHYL-HEXADECAN-
1-OL
A,B,C1BRR0.71
ODIOCTANE-1,8-DIOLA2DM50.9
BDDBROMO-DODECANOLA1N8U0.79
BDDBROMO-DODECANOLA,B1N8V0.79
5HD5-(2-hydroxyethyl)nonane-1,9-diolA3DWB0.75
F09NONAN-1-OLA,C2DWD0.9
F09NONAN-1-OLB,C1R3L0.9
F09NONAN-1-OLC,H1R3I0.9
F09NONAN-1-OLA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V
1YCE0.9
F09NONAN-1-OLC2DWE0.9
F09NONAN-1-OLA,C2HVJ0.9
F09NONAN-1-OLB,C1R3J0.9
F09NONAN-1-OLC1K4D0.9
F09NONAN-1-OLA,C1K4C0.9
F09NONAN-1-OLC2ATK0.9
F09NONAN-1-OLA,C1ZWI0.9
F09NONAN-1-OLA1ZNK0.9
F09NONAN-1-OLB,C1S5H0.9
F09NONAN-1-OLA,C2HVK0.9
F09NONAN-1-OLA,C2P7T0.9
PL3HEXADECAN-1-OLA,B,C,D2UUU0.84
PL3HEXADECAN-1-OLA,B,C,D2UUV0.84
HE4HEPTAN-1-OLA1ZNG0.83
DE1DECAN-1-OLA1ZNL0.9
OC9OCTAN-1-OLA1ZNH0.9
OC9OCTAN-1-OLA2QHV0.9
HEZHEXANE-1,6-DIOLA,B1X1V0.73
HEZHEXANE-1,6-DIOLA,B,C,D,E,F1M8T0.73
HEZHEXANE-1,6-DIOLA1J7K0.73
HEZHEXANE-1,6-DIOLA2IOR0.73
HEZHEXANE-1,6-DIOLA,D2NY20.73
HEZHEXANE-1,6-DIOLA2NY00.73
HEZHEXANE-1,6-DIOLA,B,C,D3CDO0.73
HEZHEXANE-1,6-DIOLA,B,C,D2NXZ0.73
HEZHEXANE-1,6-DIOLA,D2NY40.73
HEZHEXANE-1,6-DIOLA1P2V0.73
HEZHEXANE-1,6-DIOLA1NHZ0.73
HEZHEXANE-1,6-DIOLA,C,D,E,F,G2HY60.73
HEZHEXANE-1,6-DIOLA2NXY0.73
HEZHEXANE-1,6-DIOLA,B2VYP0.73
HEZHEXANE-1,6-DIOLA,B1JMT0.73
HEZHEXANE-1,6-DIOLA1U3C0.73
HEZHEXANE-1,6-DIOLA,B,C,D3G360.73
HEZHEXANE-1,6-DIOLA,B,C,D3EDC0.73
HEZHEXANE-1,6-DIOLA1QUH0.73
HEZHEXANE-1,6-DIOLA1IN40.73
HEZHEXANE-1,6-DIOLA,B,C,D1WXW0.73
HEZHEXANE-1,6-DIOLA,B3EV10.73
HEZHEXANE-1,6-DIOLA,B,D2WIW0.73
HEZHEXANE-1,6-DIOLA,B,C,D1IBY0.73
HEZHEXANE-1,6-DIOLA1QUD0.73
1DO1-DODECANOLA,Z2CFZ0.9
DEMDECYLOXY-METHANOLA1EK80.72