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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01727998

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HND(4S)-nonane-1,4-diolA2KAR0.71
HND(4S)-nonane-1,4-diolA2KAS0.71
OC9OCTAN-1-OLA1ZNH0.74
OC9OCTAN-1-OLA2QHV0.74
5HD5-(2-hydroxyethyl)nonane-1,9-diolA3DWB0.86
HE4HEPTAN-1-OLA1ZNG0.74
PL3HEXADECAN-1-OLA,B,C,D2UUU0.7
PL3HEXADECAN-1-OLA,B,C,D2UUV0.7
DE1DECAN-1-OLA1ZNL0.74
ARC3,7,11,15-TETRAMETHYL-HEXADECAN-
1-OL
A,B,C1BRR0.82
YES3-(2-hydroxyethyl)-2,2-bis(hydroxymethyl)pentane-
1,5-diol
A,B3GOC0.76
MHN6-METHYLHEPTAN-1-OLA,B1OYF0.86
1DO1-DODECANOLA,Z2CFZ0.74
C26(2R)-2-ETHYL-1-HEXANESULFONIC ACIDA,D1OIK0.76
ODIOCTANE-1,8-DIOLA2DM50.74
HFPALPHA-HYDROXYFARNESYLPHOSPHONIC ACIDA,B,P1QBQ0.71
HFPALPHA-HYDROXYFARNESYLPHOSPHONIC ACIDB1N9A0.71
HFPALPHA-HYDROXYFARNESYLPHOSPHONIC ACIDA,B1N940.71
HFPALPHA-HYDROXYFARNESYLPHOSPHONIC ACIDB1N950.71
HFPALPHA-HYDROXYFARNESYLPHOSPHONIC ACIDB1NI10.71
HFPALPHA-HYDROXYFARNESYLPHOSPHONIC ACIDB1NL40.71
F09NONAN-1-OLA,C2DWD0.74
F09NONAN-1-OLB,C1R3L0.74
F09NONAN-1-OLC,H1R3I0.74
F09NONAN-1-OLA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V
1YCE0.74
F09NONAN-1-OLC2DWE0.74
F09NONAN-1-OLA,C2HVJ0.74
F09NONAN-1-OLB,C1R3J0.74
F09NONAN-1-OLC1K4D0.74
F09NONAN-1-OLA,C1K4C0.74
F09NONAN-1-OLC2ATK0.74
F09NONAN-1-OLA,C1ZWI0.74
F09NONAN-1-OLA1ZNK0.74
F09NONAN-1-OLB,C1S5H0.74
F09NONAN-1-OLA,C2HVK0.74
F09NONAN-1-OLA,C2P7T0.74