MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: A78
Name: N-{1-BENZYL-3-HYDROXY-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(C
c1ccccc1)CC(C(Cc2ccccc2)NC(=O)C(C(C)C)NC(=O)N(C)Cc3cccc[nH+]3)O)NC(=O)N(C)Cc4cccc[nH+]4

[show PDB table]

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

Neutral Molecules: 19370Ionic States: 5803Tautomers: 1481Drug Similarity: 37

Items found 1 - 20 of 19370

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MMs01726844 tanimoto score: 0.84	MMs01726842 tanimoto score: 0.84	MMs02381919 tanimoto score: 0.84	MMs00028925 tanimoto score: 0.82
MMs03447452 tanimoto score: 0.82	MMs01191339 tanimoto score: 0.81	MMs01191341 tanimoto score: 0.81	MMs03943646 tanimoto score: 0.81
MMs03943643 tanimoto score: 0.81	MMs03623801 tanimoto score: 0.81	MMs03943644 tanimoto score: 0.81	MMs02887294 tanimoto score: 0.81
MMs01191334 tanimoto score: 0.81	MMs01191337 tanimoto score: 0.81	MMs00029250 tanimoto score: 0.81	MMs00028916 tanimoto score: 0.81
MMs03943645 tanimoto score: 0.81	MMs00028922 tanimoto score: 0.8	MMs00028936 tanimoto score: 0.8	MMs01187683 tanimoto score: 0.8

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