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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02138457

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,C3DP80.81
HCT(2R)-butane-1,2,4-tricarboxylic acidA,B,C3E3K0.81
PAYOCTANE-1,3,5,7-TETRACARBOXYLIC ACIDA,B2V770.72
SHVHEPTANOIC ACIDA1PO80.71
4OX4-OXODECANEDIOIC ACIDA,B1L6Y0.71
4OX4-OXODECANEDIOIC ACIDA1GJP0.71
DECSEBACIC ACIDA,B,C,D1CLS0.7
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.76
SHU4,6-DIOXOHEPTANOIC ACIDA1H7R0.73
TRCTRICARBALLYLIC ACIDA6ACN0.72
TRCTRICARBALLYLIC ACIDA,B2PW00.72
TRCTRICARBALLYLIC ACIDA5ACN0.72
DSB4,7-DIOXOSEBACIC ACIDA,B1I8J0.73
DSB4,7-DIOXOSEBACIC ACIDA1EB30.73
DSB4,7-DIOXOSEBACIC ACIDA,B1L6S0.73
DSB4,7-DIOXOSEBACIC ACIDA,B2C1H0.73
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
PMLPIMELIC ACIDA1KGT0.75
0PAcyclopentylacetic acidA,B3DWR0.89
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.85
AZ1AZELAIC ACIDA,B1TUF0.7
2PP2-PROPYL-PENTANOIC ACIDP1DIT0.7