MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: A1E
Name: (5R)-5-{[10-(1,2,3,4-TETRAHYDROACRIDIN-9-YLAMINO)DECYL]AMINO}-5,6,7,8-TETRAHYDROQUINOLIN-2(1H)-
ONE
SMILES: c1ccc2c(c1)c(c3c(n2)CCCC3)NCCCCCCCCCCNC4CCCC5=C4C=CC(=O)N5

[show PDB table]

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

Neutral Molecules: 34776Ionic States: 6047Tautomers: 1942Drug Similarity: 36

Items found 1 - 20 of 34776

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MMs00257815 tanimoto score: 0.89	MMs01088974 tanimoto score: 0.88	MMs00198294 tanimoto score: 0.88	MMs01084330 tanimoto score: 0.88
MMs02748308 tanimoto score: 0.88	MMs00288018 tanimoto score: 0.88	MMs01088973 tanimoto score: 0.88	MMs01076302 tanimoto score: 0.87
MMs00643518 tanimoto score: 0.87	MMs02168606 tanimoto score: 0.87	MMs01088976 tanimoto score: 0.87	MMs02402378 tanimoto score: 0.87
MMs00918719 tanimoto score: 0.87	MMs01072923 tanimoto score: 0.87	MMs00918718 tanimoto score: 0.87	MMs00643516 tanimoto score: 0.87
MMs01088975 tanimoto score: 0.87	MMs02692350 tanimoto score: 0.87	MMs03414587 tanimoto score: 0.87	MMs03218295 tanimoto score: 0.87