MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: AEJ
Name: (1S)-1-{4-[(9AR)-OCTAHYDRO-2H-PYRIDO[1,2-A]PYRAZIN-2-YL]PHENYL}-2-PHENYL-1,2,3,4-TETRAHYDROISOQUINOLIN-
6-OL
SMILES: c1ccc(cc1)N2CCc3cc(ccc3C2c4ccc(cc4)N5CCN6CCCCC6C5)O

[show PDB table]

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

Neutral Molecules: 7955Ionic States: 2502Tautomers: 186Drug Similarity: 19

Items found 1 - 20 of 7955

of 398 Go to Page

MMs02824029 tanimoto score: 0.88	MMs03212306 tanimoto score: 0.88	MMs01379449 tanimoto score: 0.87	MMs00944337 tanimoto score: 0.87
MMs00503398 tanimoto score: 0.87	MMs01394279 tanimoto score: 0.87	MMs01435207 tanimoto score: 0.87	MMs00883006 tanimoto score: 0.86
MMs00868616 tanimoto score: 0.86	MMs03791701 tanimoto score: 0.86	MMs00818263 tanimoto score: 0.86	MMs00868618 tanimoto score: 0.86
MMs00093481 tanimoto score: 0.86	MMs03452173 tanimoto score: 0.86	MMs01244652 tanimoto score: 0.85	MMs01987329 tanimoto score: 0.85
MMs01987327 tanimoto score: 0.85	MMs01409534 tanimoto score: 0.85	MMs00818610 tanimoto score: 0.85	MMs00818208 tanimoto score: 0.85