MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: B31
Name: (2S)-4-amino-N-[(1R,2S,3R,4R,5S)-5-amino-4-[(2,6-diamino-2,6-dideoxy-alpha-D-glucopyranosyl)oxy]-
2-hydroxy-3-(beta-D-xylofuranosyloxy)cyclohexyl]-2-hydroxybutanamide
SMILES: C1C(C(C(C(C1NC(=O)C(CCN
)O)O)OC2C(C(C(O2)CO)O)O)OC3C(C(C(C(O3)CN)O)O)N)N

[show PDB table]

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

Neutral Molecules: 1100Ionic States: 326Tautomers: 0Drug Similarity: 125

Items found 1 - 20 of 1100

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MMs01727556 tanimoto score: 0.96	MMs01727552 tanimoto score: 0.96	MMs01727550 tanimoto score: 0.96	MMs01727554 tanimoto score: 0.96
MMs03761599 tanimoto score: 0.87	MMs03480406 tanimoto score: 0.86	MMs03480410 tanimoto score: 0.86	MMs00230374 tanimoto score: 0.85
MMs00292742 tanimoto score: 0.85	MMs00292741 tanimoto score: 0.85	MMs00097569 tanimoto score: 0.85	MMs00292743 tanimoto score: 0.85
MMs03133662 tanimoto score: 0.84	MMs03133661 tanimoto score: 0.84	MMs03133663 tanimoto score: 0.84	MMs03130819 tanimoto score: 0.84
MMs03133660 tanimoto score: 0.84	MMs03133664 tanimoto score: 0.84	MMs03130816 tanimoto score: 0.84	MMs02553281 tanimoto score: 0.84

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