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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03296760

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
M1C(3S)-3-AMINO-1-(CYCLOPROPYLAMINO)HEPTANE-
2,2-DIOL
A1QXW0.74
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC0.71
HHO1-(HYDROXYMETHYLENEAMINO)-8-HYDROXY-
OCTANE
I,J1AY60.74
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVM0.74
2AO(2S)-2-AMINOHEXAN-1-OLA,I2O400.74
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOD0.74
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVQ0.74
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOC0.74
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B3D970.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2H110.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A2QYU0.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B,C,D3C2U0.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2JI70.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A1D6F0.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B3CB50.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A2BZG0.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B1XON0.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2OOQ0.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B1TB70.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B3DRA0.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2JE80.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B,C,D,E,G,
J,K,L,M,O
3CFK0.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A2C1X0.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2JI90.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
W1RV60.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2VTF0.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B1Y2D0.72
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2JI60.72