Mupirocin

Mupirocin

SCHEMBL19183296

C/C(=C\C(=O)OCCCCCCCCC(=O)O)C[C@@H]1OC[C@H](C[C@@H]2O[C@H]2[C@@H](C)[C@H](C)O)[C@@H](O)C1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ileS

The experimentally established mechanism targets of Mupirocin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IARS1 P41252 4/20 1.00
HTR2A P28223 1/20 1.00

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Mupirocin SCHEMBL18995884 1.00 IARS1 (1.00) IARS1HTR2A
Mupirocin SCHEMBL14022405 1.00 IARS1 (1.00) IARS1HTR2A
Mupirocin SCHEMBL1027616 1.00 IARS1 (1.00) IARS1HTR2A
Mupirocin SCHEMBL2223711 1.00 IARS1 (1.00) IARS1HTR2A
Mupirocin SCHEMBL3291 1.00 IARS1 (1.00) IARS1HTR2A
Mupirocin SCHEMBL15307512 1.00 IARS1 (1.00) IARS1HTR2A
Mupirocin SCHEMBL15387504 1.00 IARS1 (1.00) IARS1HTR2A
Mupirocin SCHEMBL18998277 1.00 IARS1 (1.00) IARS1HTR2A
Mupirocin SCHEMBL15387505 1.00 IARS1 (1.00) IARS1HTR2A
Mupirocin SCHEMBL14616863 1.00 IARS1 (1.00) IARS1HTR2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9717748-B2 Compositions and methods for treating an infection CMPD LICENSING, LLC (US) 2017-08-01 US disclosed
US-9717748-B2 Compositions and methods for treating an infection CMPD LICENSING, LLC (US) 2017-08-01 US disclosed