MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: IK8
Name: 1-(3-AMINO-1,2-BENZISOXAZOL-5-YL)-N-(4-{2-[(DIMETHYLAMINO)METHYL]-1H-IMIDAZOL-1-YL}-2-FLUOROPHENYL)-
3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-5-CARBOXAMIDE
SMILES: CN(C)Cc1nccn1c2ccc(c(c2)F)NC(=O)c3cc(nn3c4ccc5
c(c4)c(no5)N)C(F)(F)F

[show PDB table]

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

Neutral Molecules: 5617Ionic States: 522Tautomers: 209Drug Similarity: 1

Items found 1 - 20 of 5617

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MMs01184332 tanimoto score: 0.85	MMs01183972 tanimoto score: 0.85	MMs01183937 tanimoto score: 0.85	MMs01005944 tanimoto score: 0.84
MMs00576108 tanimoto score: 0.82	MMs01366957 tanimoto score: 0.81	MMs00923250 tanimoto score: 0.81	MMs02928240 tanimoto score: 0.81
MMs00878074 tanimoto score: 0.81	MMs02928253 tanimoto score: 0.81	MMs01048224 tanimoto score: 0.81	MMs00279950 tanimoto score: 0.8
MMs00878265 tanimoto score: 0.8	MMs01180209 tanimoto score: 0.8	MMs00665880 tanimoto score: 0.8	MMs01991647 tanimoto score: 0.8
MMs01857431 tanimoto score: 0.8	MMs00960130 tanimoto score: 0.8	MMs00656505 tanimoto score: 0.8	MMs00441594 tanimoto score: 0.8

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