MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: LIR
Name: 2-[(3S)-3-AMINOPIPERIDIN-1-YL]-1-(2-CYANOBENZYL)-5-METHYL-4,6-DIOXO-3,4,5,6-TETRAHYDROPYRROLO[3,4-
D]IMIDAZOL-1-IUM
SMILES: CN1C(=O)c2c([n+](c([nH]2)N3CCCC(C3)N)Cc4ccccc4C#N)C1=O

[show PDB table]

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

Neutral Molecules: 17243Ionic States: 2293Tautomers: 690Drug Similarity: 2

Items found 1 - 20 of 17243

of 863 Go to Page

MMs03945865 tanimoto score: 0.87	MMs03616138 tanimoto score: 0.87	MMs03616317 tanimoto score: 0.87	MMs03945017 tanimoto score: 0.87
MMs03945997 tanimoto score: 0.87	MMs03536753 tanimoto score: 0.87	MMs03351659 tanimoto score: 0.86	MMs03946293 tanimoto score: 0.86
MMs03945550 tanimoto score: 0.86	MMs03679718 tanimoto score: 0.86	MMs03389254 tanimoto score: 0.86	MMs03389247 tanimoto score: 0.86
MMs03880438 tanimoto score: 0.86	MMs03354458 tanimoto score: 0.85	MMs03354457 tanimoto score: 0.85	MMs03354504 tanimoto score: 0.85
MMs03351353 tanimoto score: 0.85	MMs03351310 tanimoto score: 0.85	MMs03354509 tanimoto score: 0.85	MMs01728712 tanimoto score: 0.85

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