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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03415521

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
KTA(S)-CYCLOHEXANONE-2-ACETATEA,B2J5S0.81
PAYOCTANE-1,3,5,7-TETRACARBOXYLIC ACIDA,B2V770.73
RDIRADICICOLA1QY80.7
DEB6-DEOXYERYTHRONOLIDE BA1Z8P0.82
DEB6-DEOXYERYTHRONOLIDE BA1JIO0.82
DEB6-DEOXYERYTHRONOLIDE BA1Z8Q0.82
DEB6-DEOXYERYTHRONOLIDE BA1OXA0.82
DEB6-DEOXYERYTHRONOLIDE BA1Z8O0.82
F24(3R,5S,7R,12S,13R)-13-FORMYL-12,14-
DIHYDROXY-3,5,7-TRIMETHYLTETRADECANOIC ACID
A2F9A0.79
HXD(3R)-3-HYDROXYDODECANOIC ACIDA2DDH0.74
YML[(3R,4S,5S,7R)-4,8-DIHYDROXY-3,5,7-
TRIMETHYL-2-OXOOCTYL]PHOSPHONIC ACID
A,B2HFJ0.7
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFF0.74
FTT3-HYDROXY-TETRADECANOIC ACIDA1QJQ0.74
FTT3-HYDROXY-TETRADECANOIC ACIDA,B2GRX0.74
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFG0.74
FTT3-HYDROXY-TETRADECANOIC ACIDA1QKC0.74
FTT3-HYDROXY-TETRADECANOIC ACIDA1FI10.74
FTT3-HYDROXY-TETRADECANOIC ACIDA,B,C,D3FXI0.74
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.74
DQA1,3,4-TRIHYDROXY-5-OXO-CYCLOHEXANECARBOXYLIC ACIDA1J2Y0.74
CAH5-EXO-HYDROXYCAMPHORA1NOO0.72