MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: AXD
Name: 2-[4-({2-[(2S,5R)-2-(AMINOMETHYL)-5-ETHYNYLPYRROLIDIN-1-YL]-2-OXOETHYL}AMINO)-4-METHYLPIPERIDIN-
1-YL]ISONICOTINIC ACID
SMILES: CC1(CCN(CC1)c2cc(ccn2)C(=O)O)NCC(=O)N3C(CCC3C#C)CN

[show PDB table]

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

Neutral Molecules: 9670Ionic States: 2712Tautomers: 1484Drug Similarity: 13

Items found 1 - 20 of 9670

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MMs00442212 tanimoto score: 0.85	MMs01120305 tanimoto score: 0.85	MMs00274399 tanimoto score: 0.84	MMs00442288 tanimoto score: 0.84
MMs00274395 tanimoto score: 0.83	MMs00274397 tanimoto score: 0.83	MMs00329127 tanimoto score: 0.83	MMs00480313 tanimoto score: 0.82
MMs00480312 tanimoto score: 0.82	MMs00480784 tanimoto score: 0.82	MMs00480783 tanimoto score: 0.82	MMs00480781 tanimoto score: 0.82
MMs00480782 tanimoto score: 0.82	MMs00329125 tanimoto score: 0.82	MMs00456548 tanimoto score: 0.81	MMs00456547 tanimoto score: 0.81
MMs03853368 tanimoto score: 0.81	MMs01005470 tanimoto score: 0.81	MMs00064177 tanimoto score: 0.8	MMs00387047 tanimoto score: 0.8

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