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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02028313

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CAH5-EXO-HYDROXYCAMPHORA1NOO0.81
PAYOCTANE-1,3,5,7-TETRACARBOXYLIC ACIDA,B2V770.75
KTA(S)-CYCLOHEXANONE-2-ACETATEA,B2J5S0.82
CAX(2S,4S)-4-(2,2-DIHYDROXYETHYL)-
2,3,3-TRIMETHYLCYCLOPENTANONE
A,B,C,D,E,F,
G,H,I,J,K,L
1SZO0.76
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.75
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.73
3OC(1R)-3-oxocyclohexanecarboxylic acidA,B3DZL0.71
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.73
CAMCAMPHORA6CP40.73
CAMCAMPHORA,B2FEU0.73
CAMCAMPHORA1GEB0.73
CAMCAMPHORA3FWI0.73
CAMCAMPHORA2Z970.73
CAMCAMPHORA,B1O760.73
CAMCAMPHORA,B2A1N0.73
CAMCAMPHORA2QBO0.73
CAMCAMPHORA1AKD0.73
CAMCAMPHORA2CPP0.73
CAMCAMPHORA,B3FWG0.73
CAMCAMPHORA2QBM0.73
CAMCAMPHORA2ZAW0.73
CAMCAMPHORA1IWJ0.73
CAMCAMPHORA4CP40.73
CAMCAMPHORA3CPP0.73
CAMCAMPHORA1YRC0.73
CAMCAMPHORA2QBL0.73
CAMCAMPHORA,B1T860.73
CAMCAMPHORA1T850.73
CAMCAMPHORA,B1UYU0.73
CAMCAMPHORA2ZAX0.73
CAMCAMPHORA2ZWT0.73
CAMCAMPHORA,B1T880.73
CAMCAMPHORA5CP40.73
CAMCAMPHORA,B2A1O0.73
CAMCAMPHORA,B,K1DZ90.73
CAMCAMPHORA,B1T870.73
CAMCAMPHORA1YRD0.73
CAMCAMPHORA,B,K1DZ80.73
CAMCAMPHORA,B2A1M0.73
CAMCAMPHORA3FWJ0.73
CAMCAMPHORA2CP40.73
CAMCAMPHORA,B3FWF0.73
CAMCAMPHORA2QBN0.73
CAMCAMPHORA,B,K1DZ60.73
CAMCAMPHORA1IWI0.73
CAMCAMPHORA,B,K1DZ40.73
CAMCAMPHORA2ZWU0.73