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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00024705

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AC01-PHENYLETHANONEA1ZK10.78
AC01-PHENYLETHANONEA1ZK40.78
3PL3-PHENYLPROPANALE1Y3G0.81
LEG1-(4-HEXYLPHENYL)PROP-2-EN-1-ONEA,B2PIN0.76
HBXbenzaldehydeA,B3GDN0.9
VK3MENADIONEA1TUV0.71
VK3MENADIONEA,B2QR20.71
PBP1-(4-BROMO-PHENYL)-ETHANONEA,B2OK90.7
PBP1-(4-BROMO-PHENYL)-ETHANONEA,B1Z760.7
PBP1-(4-BROMO-PHENYL)-ETHANONEA1BK90.7
BZQDIPHENYLMETHANONEA,B1GT50.76
BZQDIPHENYLMETHANONEA,B1DZP0.76
HPK(3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATEA2PUH0.71
DMW2,3-DIMETHYL-1,4-NAPHTHOQUINONEA,B,C,D,E,F2BS40.71
1LPTRANYLCYPROMINEA,B1OJB0.78
C0E3-fluoro-6-(4-fluorophenyl)-2-hydroxy-
6-oxohexa-2,4-dienoic acid
A2RHW0.7
BP4BIPHENYL-4-YL-ACETALDEHYDEA,B,E,F,G,H1MHW0.77
HY1PHENYLACETALDEHYDED,H2I0S0.83
HY1PHENYLACETALDEHYDEA,B1D6Y0.83
HY1PHENYLACETALDEHYDEA,B1D6Z0.83
HY1PHENYLACETALDEHYDED,H2OK40.83
HY1PHENYLACETALDEHYDEA,B1D6U0.83