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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02215977

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
0PAcyclopentylacetic acidA,B3DWR0.71
F24(3R,5S,7R,12S,13R)-13-FORMYL-12,14-
DIHYDROXY-3,5,7-TRIMETHYLTETRADECANOIC ACID
A2F9A0.8
3OC(1R)-3-oxocyclohexanecarboxylic acidA,B3DZL0.75
DEB6-DEOXYERYTHRONOLIDE BA1Z8P0.76
DEB6-DEOXYERYTHRONOLIDE BA1JIO0.76
DEB6-DEOXYERYTHRONOLIDE BA1Z8Q0.76
DEB6-DEOXYERYTHRONOLIDE BA1OXA0.76
DEB6-DEOXYERYTHRONOLIDE BA1Z8O0.76
DQA1,3,4-TRIHYDROXY-5-OXO-CYCLOHEXANECARBOXYLIC ACIDA1J2Y0.71
HXD(3R)-3-HYDROXYDODECANOIC ACIDA2DDH0.81
BFC(R)-3-HYDROXYTETRADECANALA2NPV0.7
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFF0.81
FTT3-HYDROXY-TETRADECANOIC ACIDA1QJQ0.81
FTT3-HYDROXY-TETRADECANOIC ACIDA,B2GRX0.81
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFG0.81
FTT3-HYDROXY-TETRADECANOIC ACIDA1QKC0.81
FTT3-HYDROXY-TETRADECANOIC ACIDA1FI10.81
FTT3-HYDROXY-TETRADECANOIC ACIDA,B,C,D3FXI0.81
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.72
KTA(S)-CYCLOHEXANONE-2-ACETATEA,B2J5S0.75
LIL2-TRIDECANOYLOXY-PENTADECANOIC ACIDA2FCP0.75
LIL2-TRIDECANOYLOXY-PENTADECANOIC ACIDA1FCP0.75
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.72
GVM(3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACIDA,B2UW10.78
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HFE0.71
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2H8P0.71
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HG50.71
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.77