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 81 - 100 of 17243

of 863 Go to Page

MMs03606905 tanimoto score: 0.85	MMs03616096 tanimoto score: 0.85	MMs03945857 tanimoto score: 0.85	MMs03616257 tanimoto score: 0.85
MMs03351148 tanimoto score: 0.85	MMs00349409 tanimoto score: 0.84	MMs03386989 tanimoto score: 0.84	MMs00078022 tanimoto score: 0.84
MMs00349407 tanimoto score: 0.84	MMs03386985 tanimoto score: 0.84	MMs03366981 tanimoto score: 0.84	MMs03366975 tanimoto score: 0.84
MMs00338272 tanimoto score: 0.84	MMs03366977 tanimoto score: 0.84	MMs00078016 tanimoto score: 0.84	MMs00327552 tanimoto score: 0.84
MMs03366396 tanimoto score: 0.84	MMs03365584 tanimoto score: 0.84	MMs03364477 tanimoto score: 0.84	MMs03363946 tanimoto score: 0.84

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