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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02430841

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,B2J5S0.88
PMLPIMELIC ACIDA1KGT0.71
SHVHEPTANOIC ACIDA1PO80.71
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.76
PAYOCTANE-1,3,5,7-TETRACARBOXYLIC ACIDA,B2V770.75
4AT5-OXOHEXANOIC ACIDA,B2EFY0.76
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.73
CCM1-METHYL-1-CARBOXY-CYCLOPENTANEA1THL0.74
3OC(1R)-3-oxocyclohexanecarboxylic acidA,B3DZL0.81
HCT(2R)-butane-1,2,4-tricarboxylic acidA,B,C3DP80.73
HCT(2R)-butane-1,2,4-tricarboxylic acidA,B,C3E3K0.73
0PAcyclopentylacetic acidA,B3DWR0.89
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.85
2PP2-PROPYL-PENTANOIC ACIDP1DIT0.7