MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: BTH
Name: 4-OXO-3-{6-[4-(QUINOXALIN-2-YLAMINO)-BENZOYLAMINO]-2-THIOPHEN-2-YL-HEXANOYLAMINO}-PENTANOIC ACID
SMILES: C
C(=O)C(CC(=O)O)NC(=O)C(CCCCNC(=O)c1ccc(cc1)Nc2cnc3ccccc3n2)c4cccs4

[show PDB table]

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

Neutral Molecules: 12167Ionic States: 1522Tautomers: 933Drug Similarity: 9

Items found 1 - 20 of 12167

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MMs02273826 tanimoto score: 0.89	MMs02297157 tanimoto score: 0.87	MMs02477860 tanimoto score: 0.86	MMs02491582 tanimoto score: 0.86
MMs02478688 tanimoto score: 0.83	MMs02230896 tanimoto score: 0.82	MMs01058933 tanimoto score: 0.82	MMs01022813 tanimoto score: 0.81
MMs01022810 tanimoto score: 0.81	MMs01022822 tanimoto score: 0.81	MMs01022801 tanimoto score: 0.81	MMs00207044 tanimoto score: 0.81
MMs01022811 tanimoto score: 0.81	MMs01022812 tanimoto score: 0.81	MMs01022798 tanimoto score: 0.81	MMs01022765 tanimoto score: 0.81
MMs01022799 tanimoto score: 0.81	MMs01022762 tanimoto score: 0.81	MMs00207045 tanimoto score: 0.81	MMs01022763 tanimoto score: 0.81

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