MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: A77
Name: N-{1-BENZYL-(2R,3S)-2,3-DIHYDROXY-4-[3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRYLAMINO]-
5-PHENYL-PENTYL}-3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRAMIDE
SMILES: CC(C)C(C(=O)NC
(Cc1ccccc1)C(C(C(Cc2ccccc2)NC(=O)C(C(C)C)NC(=O)N(C)Cc3ccccn3)O)O)NC(=O)N(C)Cc4ccccn4

[show PDB table]

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

Neutral Molecules: 18782Ionic States: 5526Tautomers: 1552Drug Similarity: 34

Items found 801 - 820 of 18782

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MMs02983787 tanimoto score: 0.76	MMs02983793 tanimoto score: 0.76	MMs02970022 tanimoto score: 0.76	MMs01131115 tanimoto score: 0.76
MMs01140027 tanimoto score: 0.76	MMs02970025 tanimoto score: 0.76	MMs02983796 tanimoto score: 0.76	MMs02907712 tanimoto score: 0.76
MMs00302773 tanimoto score: 0.76	MMs02908087 tanimoto score: 0.76	MMs01191073 tanimoto score: 0.76	MMs01131353 tanimoto score: 0.76
MMs00035484 tanimoto score: 0.76	MMs03074077 tanimoto score: 0.76	MMs02908089 tanimoto score: 0.76	MMs00028926 tanimoto score: 0.76
MMs01191248 tanimoto score: 0.76	MMs02983797 tanimoto score: 0.76	MMs03073775 tanimoto score: 0.76	MMs03230342 tanimoto score: 0.76

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