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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03912688

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.87
CCM1-METHYL-1-CARBOXY-CYCLOPENTANEA1THL0.76
3OC(1R)-3-oxocyclohexanecarboxylic acidA,B3DZL0.91
KTA(S)-CYCLOHEXANONE-2-ACETATEA,B2J5S0.78
4OX4-OXODECANEDIOIC ACIDA,B1L6Y0.77
4OX4-OXODECANEDIOIC ACIDA1GJP0.77
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.75
0PAcyclopentylacetic acidA,B3DWR0.91
SHU4,6-DIOXOHEPTANOIC ACIDA1H7R0.78
DSB4,7-DIOXOSEBACIC ACIDA,B1I8J0.78
DSB4,7-DIOXOSEBACIC ACIDA1EB30.78
DSB4,7-DIOXOSEBACIC ACIDA,B1L6S0.78
DSB4,7-DIOXOSEBACIC ACIDA,B2C1H0.78
PMLPIMELIC ACIDA1KGT0.73
HCT(2R)-butane-1,2,4-tricarboxylic acidA,B,C3DP80.75
HCT(2R)-butane-1,2,4-tricarboxylic acidA,B,C3E3K0.75
2PP2-PROPYL-PENTANOIC ACIDP1DIT0.72
OHA10-oxohexadecanoic acidA,B,C,D2OD60.71
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.77
SHVHEPTANOIC ACIDA1PO80.73