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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00022183

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
OC9OCTAN-1-OLA1ZNH0.84
OC9OCTAN-1-OLA2QHV0.84
DE1DECAN-1-OLA1ZNL0.84
MHN6-METHYLHEPTAN-1-OLA,B1OYF0.7
HE4HEPTAN-1-OLA1ZNG0.78
1DO1-DODECANOLA,Z2CFZ0.84
ODIOCTANE-1,8-DIOLA2DM50.84
5HD5-(2-hydroxyethyl)nonane-1,9-diolA3DWB0.71
BDDBROMO-DODECANOLA1N8U0.75
BDDBROMO-DODECANOLA,B1N8V0.75
PL3HEXADECAN-1-OLA,B,C,D2UUU0.79
PL3HEXADECAN-1-OLA,B,C,D2UUV0.79
HND(4S)-nonane-1,4-diolA2KAR0.75
HND(4S)-nonane-1,4-diolA2KAS0.75
F09NONAN-1-OLA,C2DWD0.84
F09NONAN-1-OLB,C1R3L0.84
F09NONAN-1-OLC,H1R3I0.84
F09NONAN-1-OLA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V
1YCE0.84
F09NONAN-1-OLC2DWE0.84
F09NONAN-1-OLA,C2HVJ0.84
F09NONAN-1-OLB,C1R3J0.84
F09NONAN-1-OLC1K4D0.84
F09NONAN-1-OLA,C1K4C0.84
F09NONAN-1-OLC2ATK0.84
F09NONAN-1-OLA,C1ZWI0.84
F09NONAN-1-OLA1ZNK0.84
F09NONAN-1-OLB,C1S5H0.84
F09NONAN-1-OLA,C2HVK0.84
F09NONAN-1-OLA,C2P7T0.84