MMsINC Database Search
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Ligand PDB



ligand: JB1
Name: (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R,3S)-3-(2-hydroxyethyl)heptan-2-yl]-7a-methyl-2,3,3a,5,6,7-
hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidene-cyclohexane-1,3-diol
SMILES: CCCCC(CCO)C(C)C1
CCC2C1(CCCC2=CC=C3CC(CC(C3=C)O)O)C
[show PDB table]


MMsINC molecules which have a Tanimoto coefficient superior or equal to 0.70

Neutral Molecules: 5035Ionic States: 232Tautomers: 80Drug Similarity: 60 Items found 1 - 20 of 5035 



of 252    Go to Page   



MMs03463607
tanimoto score: 1

MMs03506262
tanimoto score: 1

MMs03374384
tanimoto score: 1

MMs03445234
tanimoto score: 0.99

MMs01726149
tanimoto score: 0.99

MMs01726151
tanimoto score: 0.99

MMs03520524
tanimoto score: 0.99

MMs03506157
tanimoto score: 0.99

MMs01726150
tanimoto score: 0.99

MMs03921548
tanimoto score: 0.99

MMs03365086
tanimoto score: 0.99

MMs01726152
tanimoto score: 0.99

MMs00457953
tanimoto score: 0.99

MMs03269792
tanimoto score: 0.97

MMs03373146
tanimoto score: 0.97

MMs03495638
tanimoto score: 0.97

MMs01725967
tanimoto score: 0.97

MMs03462845
tanimoto score: 0.97

MMs03445026
tanimoto score: 0.97

MMs01725964
tanimoto score: 0.97


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