MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: KHA
Name: 1-(4-{[(2-HYDROXYETHYL)AMINO]CARBONYL}BENZYL)-1-METHYLPIPERIDINIUM
SMILES: C[N+]1(CCCCC1)Cc2ccc(cc2)
C(=O)NCCO

[show PDB table]

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

Neutral Molecules: 71191Ionic States: 19018Tautomers: 4437Drug Similarity: 52

Items found 21 - 40 of 71191

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MMs03622579 tanimoto score: 0.93	MMs03252626 tanimoto score: 0.93	MMs03611168 tanimoto score: 0.93	MMs00263505 tanimoto score: 0.93
MMs02334269 tanimoto score: 0.93	MMs00036876 tanimoto score: 0.92	MMs00352865 tanimoto score: 0.92	MMs03667454 tanimoto score: 0.92
MMs02949386 tanimoto score: 0.92	MMs03126245 tanimoto score: 0.92	MMs00382024 tanimoto score: 0.92	MMs03177486 tanimoto score: 0.92
MMs00436126 tanimoto score: 0.91	MMs00382028 tanimoto score: 0.91	MMs00803104 tanimoto score: 0.91	MMs02259057 tanimoto score: 0.91
MMs00163562 tanimoto score: 0.91	MMs02668518 tanimoto score: 0.91	MMs00317376 tanimoto score: 0.91	MMs00779906 tanimoto score: 0.91

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