MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: AIT
Name: (2S,3R)-3-(4-HYDROXYPHENYL)-2-(4-{[(2R)-2-PYRROLIDIN-1-YLPROPYL]OXY}PHENYL)-2,3-DIHYDRO-1,4-
BENZOXATHIIN-6-OL
SMILES: CC(COc1ccc(cc1)C2C(Sc3cc(ccc3O2)O)c4ccc(cc4)O)N5CCCC5

[show PDB table]

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

Neutral Molecules: 3597Ionic States: 1061Tautomers: 249Drug Similarity: 19

Items found 1 - 20 of 3597

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MMs02218960 tanimoto score: 0.87	MMs02180441 tanimoto score: 0.83	MMs02180437 tanimoto score: 0.83	MMs02180439 tanimoto score: 0.83
MMs02180435 tanimoto score: 0.83	MMs03310676 tanimoto score: 0.82	MMs02304479 tanimoto score: 0.82	MMs03936130 tanimoto score: 0.81
MMs03319686 tanimoto score: 0.81	MMs03310710 tanimoto score: 0.81	MMs03319690 tanimoto score: 0.81	MMs02304477 tanimoto score: 0.8
MMs02405210 tanimoto score: 0.8	MMs02180413 tanimoto score: 0.79	MMs02262108 tanimoto score: 0.79	MMs02180415 tanimoto score: 0.79
MMs03076132 tanimoto score: 0.79	MMs03125228 tanimoto score: 0.79	MMs02496510 tanimoto score: 0.79	MMs02711392 tanimoto score: 0.79

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