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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03131310

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.79
TRCTRICARBALLYLIC ACIDA6ACN0.71
TRCTRICARBALLYLIC ACIDA,B2PW00.71
TRCTRICARBALLYLIC ACIDA5ACN0.71
HCT(2R)-butane-1,2,4-tricarboxylic acidA,B,C3DP80.79
HCT(2R)-butane-1,2,4-tricarboxylic acidA,B,C3E3K0.79
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID
A,B1CEB0.7
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID
A1B2I0.7
0PAcyclopentylacetic acidA,B3DWR0.79
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.79
DECSEBACIC ACIDA,B,C,D1CLS0.72
3OC(1R)-3-oxocyclohexanecarboxylic acidA,B3DZL0.8
KTA(S)-CYCLOHEXANONE-2-ACETATEA,B2J5S0.86
PAYOCTANE-1,3,5,7-TETRACARBOXYLIC ACIDA,B2V770.88
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.85
PMLPIMELIC ACIDA1KGT0.73
2PP2-PROPYL-PENTANOIC ACIDP1DIT0.72
AZ1AZELAIC ACIDA,B1TUF0.72