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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03446345

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HCT(2R)-butane-1,2,4-tricarboxylic acidA,B,C3DP80.71
HCT(2R)-butane-1,2,4-tricarboxylic acidA,B,C3E3K0.71
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.71
RSH3-DEOXY-D-LYXO-HEXONIC ACIDA,B,C,D1W3T0.7
PAYOCTANE-1,3,5,7-TETRACARBOXYLIC ACIDA,B2V770.72
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.72
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.71
KTA(S)-CYCLOHEXANONE-2-ACETATEA,B2J5S0.7
0PAcyclopentylacetic acidA,B3DWR0.7
2PP2-PROPYL-PENTANOIC ACIDP1DIT0.74
GVM(3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACIDA,B2UW10.74
SSH3-DEOXY-D-ARABINO-HEXONIC ACIDA,B,C,D1W3N0.7
1LU4-METHYL-PENTANOIC ACID-2-OXYL GROUPE,I6TMN0.72
1LU4-METHYL-PENTANOIC ACID-2-OXYL GROUPI1DS20.72
F24(3R,5S,7R,12S,13R)-13-FORMYL-12,14-
DIHYDROXY-3,5,7-TRIMETHYLTETRADECANOIC ACID
A2F9A0.7
DEB6-DEOXYERYTHRONOLIDE BA1Z8P0.75
DEB6-DEOXYERYTHRONOLIDE BA1JIO0.75
DEB6-DEOXYERYTHRONOLIDE BA1Z8Q0.75
DEB6-DEOXYERYTHRONOLIDE BA1OXA0.75
DEB6-DEOXYERYTHRONOLIDE BA1Z8O0.75
MEV(R)-MEVALONATEA,B1QAY0.71
MEV(R)-MEVALONATEA2HFU0.71
MEV(R)-MEVALONATEA,B1R310.71