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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02260169

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NBA3-[(3-{[3-(METHYLAMINO)PROPYL]AMINO}PROPYL)AMINO]PROPANE-
1,1-DIOL
A,B,C1H860.71
NBA3-[(3-{[3-(METHYLAMINO)PROPYL]AMINO}PROPYL)AMINO]PROPANE-
1,1-DIOL
A,B,C1H840.71
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B3D970.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2H110.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A2QYU0.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B,C,D3C2U0.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2JI70.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A1D6F0.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B3CB50.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A2BZG0.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B1XON0.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2OOQ0.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B1TB70.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B3DRA0.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2JE80.76
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
3CFK0.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A2C1X0.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2JI90.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
W1RV60.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2VTF0.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B1Y2D0.76
B3P2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-
ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-
PROPANE-1,3-DIOL
A,B2JI60.76
DO310-((2R)-2-HYDROXYPROPYL)-1,4,7,10-
TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID
A1H870.72
DO310-((2R)-2-HYDROXYPROPYL)-1,4,7,10-
TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID
A,B,C,D,E,F,
G,H
2QMI0.72