MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: 446
Name: 4-[(4-{[6-bromo-3-(methoxycarbonyl)-1-oxo-4-phenylisoquinolin-2(1H)-yl]methyl}phenyl)amino]-
4-oxobutanoic acid
SMILES: COC(=O)C1=C(c2cc(ccc2C(=O)N1Cc3ccc(cc3)NC(=O)CCC(=O)O)Br)c4ccccc4

[show PDB table]

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

Neutral Molecules: 16229Ionic States: 1700Tautomers: 496Drug Similarity: 3

Items found 1 - 20 of 16229

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MMs00185575 tanimoto score: 0.83	MMs00185574 tanimoto score: 0.83	MMs00685234 tanimoto score: 0.82	MMs02204628 tanimoto score: 0.82
MMs00685233 tanimoto score: 0.82	MMs02204629 tanimoto score: 0.82	MMs00937253 tanimoto score: 0.81	MMs00685247 tanimoto score: 0.81
MMs01265892 tanimoto score: 0.81	MMs00222906 tanimoto score: 0.81	MMs00685248 tanimoto score: 0.81	MMs00937221 tanimoto score: 0.8
MMs01692531 tanimoto score: 0.8	MMs01367922 tanimoto score: 0.8	MMs01450397 tanimoto score: 0.8	MMs00784326 tanimoto score: 0.8
MMs00740627 tanimoto score: 0.8	MMs00927815 tanimoto score: 0.8	MMs01337161 tanimoto score: 0.8	MMs01450399 tanimoto score: 0.8

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