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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02383006

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
0PAcyclopentylacetic acidA,B3DWR0.76
DEB6-DEOXYERYTHRONOLIDE BA1Z8P0.71
DEB6-DEOXYERYTHRONOLIDE BA1JIO0.71
DEB6-DEOXYERYTHRONOLIDE BA1Z8Q0.71
DEB6-DEOXYERYTHRONOLIDE BA1OXA0.71
DEB6-DEOXYERYTHRONOLIDE BA1Z8O0.71
12H12-HYDROXYDODECANOIC ACIDA,B1M6W0.7
3OC(1R)-3-oxocyclohexanecarboxylic acidA,B3DZL0.8
GVM(3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACIDA,B2UW10.75
F24(3R,5S,7R,12S,13R)-13-FORMYL-12,14-
DIHYDROXY-3,5,7-TRIMETHYLTETRADECANOIC ACID
A2F9A0.78
KTA(S)-CYCLOHEXANONE-2-ACETATEA,B2J5S0.75
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.78
DQA1,3,4-TRIHYDROXY-5-OXO-CYCLOHEXANECARBOXYLIC ACIDA1J2Y0.74
1N5(2R,4S)-2,4,7-trihydroxyheptanoic acidA,B3CXO0.7
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFF0.78
FTT3-HYDROXY-TETRADECANOIC ACIDA1QJQ0.78
FTT3-HYDROXY-TETRADECANOIC ACIDA,B2GRX0.78
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFG0.78
FTT3-HYDROXY-TETRADECANOIC ACIDA1QKC0.78
FTT3-HYDROXY-TETRADECANOIC ACIDA1FI10.78
FTT3-HYDROXY-TETRADECANOIC ACIDA,B,C,D3FXI0.78
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.73
HXD(3R)-3-HYDROXYDODECANOIC ACIDA2DDH0.78
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I1E800.7
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I1EED0.7
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I2ER00.7