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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00399664

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.8
KTA(S)-CYCLOHEXANONE-2-ACETATEA,B2J5S0.88
3OC(1R)-3-oxocyclohexanecarboxylic acidA,B3DZL0.75
DSB4,7-DIOXOSEBACIC ACIDA,B1I8J0.71
DSB4,7-DIOXOSEBACIC ACIDA1EB30.71
DSB4,7-DIOXOSEBACIC ACIDA,B1L6S0.71
DSB4,7-DIOXOSEBACIC ACIDA,B2C1H0.71
DECSEBACIC ACIDA,B,C,D1CLS0.72
GBN[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACIDA,B2COJ0.71
GBN[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACIDA,B,C2EJ30.71
GBN[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACIDA,B2A1H0.71
GBN[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACIDA,B2COI0.71
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.75
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.72
PAYOCTANE-1,3,5,7-TETRACARBOXYLIC ACIDA,B2V770.8
AZ1AZELAIC ACIDA,B1TUF0.72
OHA10-oxohexadecanoic acidA,B,C,D2OD60.71
4OX4-OXODECANEDIOIC ACIDA,B1L6Y0.73
4OX4-OXODECANEDIOIC ACIDA1GJP0.73