MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: CA2
Name: (1S,3R,4R,5S)-1,3,4-TRIHYDROXY-5-(3-PHENOXYPROPYL)CYCLOHEXANECARBOXYLIC ACID
SMILES: c1ccc(cc1)OCCCC
2CC(CC(C2O)O)(C(=O)O)O

[show PDB table]

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

Neutral Molecules: 48130Ionic States: 5349Tautomers: 1818Drug Similarity: 58

Items found 1 - 20 of 48130

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MMs03089871 tanimoto score: 0.91	MMs02544012 tanimoto score: 0.9	MMs00478399 tanimoto score: 0.9	MMs02550755 tanimoto score: 0.9
MMs00478401 tanimoto score: 0.9	MMs00459300 tanimoto score: 0.89	MMs00459298 tanimoto score: 0.89	MMs00721878 tanimoto score: 0.88
MMs02520082 tanimoto score: 0.88	MMs03468567 tanimoto score: 0.88	MMs02269930 tanimoto score: 0.88	MMs00760430 tanimoto score: 0.88
MMs02890237 tanimoto score: 0.87	MMs02758255 tanimoto score: 0.87	MMs02421716 tanimoto score: 0.87	MMs02421713 tanimoto score: 0.87
MMs02421714 tanimoto score: 0.87	MMs02309371 tanimoto score: 0.87	MMs02421715 tanimoto score: 0.87	MMs03127446 tanimoto score: 0.87