MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: IHJ
Name: 9-CYCLOPENTYL-6-{2-[3-(4-METHYL-PIPERAZIN-1-YL)-PROPOXY]-PHENYLAMINO}-9H-PURINE-2-CARBONITRILE
SMILES: C
N1CCN(CC1)CCCOc2ccccc2Nc3c4c(nc(n3)C#N)n(cn4)C5CCCC5

[show PDB table]

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

Neutral Molecules: 25491Ionic States: 2596Tautomers: 467Drug Similarity: 6

Items found 1 - 20 of 25491

of 1275 Go to Page

MMs01058388 tanimoto score: 0.95	MMs01058379 tanimoto score: 0.93	MMs01058386 tanimoto score: 0.92	MMs01058214 tanimoto score: 0.91
MMs00845882 tanimoto score: 0.9	MMs01058387 tanimoto score: 0.9	MMs01058396 tanimoto score: 0.9	MMs01058383 tanimoto score: 0.89
MMs01058381 tanimoto score: 0.89	MMs02082198 tanimoto score: 0.89	MMs02815072 tanimoto score: 0.89	MMs01007055 tanimoto score: 0.89
MMs00657859 tanimoto score: 0.89	MMs01058201 tanimoto score: 0.89	MMs01064931 tanimoto score: 0.88	MMs01058210 tanimoto score: 0.88
MMs02082242 tanimoto score: 0.88	MMs01000865 tanimoto score: 0.87	MMs02007864 tanimoto score: 0.87	MMs02001402 tanimoto score: 0.87