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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02265549

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BUQ4-HYDROXY-2-BUTANONEA,B1D7J0.74
SHFLAEVULINIC ACIDA1YLV0.7
SHFLAEVULINIC ACIDA1H7N0.7
SHO5-HYDROXYLAEVULINIC ACIDA1W310.75
HE2HEXAN-1-OLA1ZNE0.72
HEZHEXANE-1,6-DIOLA,B1X1V0.72
HEZHEXANE-1,6-DIOLA,B,C,D,E,F1M8T0.72
HEZHEXANE-1,6-DIOLA1J7K0.72
HEZHEXANE-1,6-DIOLA2IOR0.72
HEZHEXANE-1,6-DIOLA,D2NY20.72
HEZHEXANE-1,6-DIOLA2NY00.72
HEZHEXANE-1,6-DIOLA,B,C,D3CDO0.72
HEZHEXANE-1,6-DIOLA,B,C,D2NXZ0.72
HEZHEXANE-1,6-DIOLA,D2NY40.72
HEZHEXANE-1,6-DIOLA1P2V0.72
HEZHEXANE-1,6-DIOLA1NHZ0.72
HEZHEXANE-1,6-DIOLA,C,D,E,F,G2HY60.72
HEZHEXANE-1,6-DIOLA2NXY0.72
HEZHEXANE-1,6-DIOLA,B2VYP0.72
HEZHEXANE-1,6-DIOLA,B1JMT0.72
HEZHEXANE-1,6-DIOLA1U3C0.72
HEZHEXANE-1,6-DIOLA,B,C,D3G360.72
HEZHEXANE-1,6-DIOLA,B,C,D3EDC0.72
HEZHEXANE-1,6-DIOLA1QUH0.72
HEZHEXANE-1,6-DIOLA1IN40.72
HEZHEXANE-1,6-DIOLA,B,C,D1WXW0.72
HEZHEXANE-1,6-DIOLA,B3EV10.72
HEZHEXANE-1,6-DIOLA,B,D2WIW0.72
HEZHEXANE-1,6-DIOLA,B,C,D1IBY0.72
HEZHEXANE-1,6-DIOLA1QUD0.72
4AT5-OXOHEXANOIC ACIDA,B2EFY0.76
GAQ5-HYDROXYPENTANALA,B1ZLP0.79
6NAHEXANOIC ACIDA,B2IX40.72
6NAHEXANOIC ACIDA,B2IWZ0.72
6NAHEXANOIC ACIDA2IQ00.72