Pseudoephedrine

Pseudoephedrine

SCHEMBL118099

CN[C@@H](C)[C@@H](O)c1ccccc1.Cl.Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC6A2

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 known ✓ P23975 2/20 0.48
▸ KMT2A Q03164 2/20 1.00
▸ MEN1 O00255 1/20 1.00
▸ HBB P68871 1/20 1.00
▸ ADRA2C P18825 2/20 0.96
▸ CYP2D6 P10635 2/20 0.96
▸ CYP2C19 P33261 2/20 0.96
▸ CHRM2 P08172 1/20 0.96
▸ ADRA1A P35348 1/20 0.96
▸ RGS12 O14924 1/20 0.96
▸ GLA P06280 1/20 0.96
▸ CYP3A4 P08684 1/20 0.96
▸ CYP2C9 P11712 1/20 0.96
▸ PKM P14618 1/20 0.96
▸ ALOX15 P16050 1/20 0.96
▸ TSHR P16473 1/20 0.96
▸ ALOX12 P18054 1/20 0.96
▸ NFKB1 P19838 1/20 0.96
▸ HTR2A P28223 1/20 0.96
▸ THPO P40225 1/20 0.96

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
Pseudoephedrine SCHEMBL33285 1.00 KMT2A (1.00) KMT2AMEN1HBBADRA2CCYP2D6
Racephedrine SCHEMBL321655 1.00 KMT2A (1.00) KMT2AMEN1HBBADRA2CCYP2D6
Ephedrine SCHEMBL22822 1.00 KMT2A (1.00) KMT2AMEN1HBBADRA2CCYP2D6
Racephedrine SCHEMBL28253267 1.00 KMT2A (1.00) KMT2AMEN1HBBADRA2CCYP2D6
Racephedrine SCHEMBL22824 1.00 KMT2A (1.00) KMT2AMEN1HBBADRA2CCYP2D6
Racephedrine SCHEMBL22823 1.00 KMT2A (1.00) KMT2AMEN1HBBADRA2CCYP2D6
Racephedrine SCHEMBL27878452 0.98 KMT2A (0.96) KMT2AMEN1HBBADRA2CCYP2D6
Racephedrine SCHEMBL9413942 0.98 KMT2A (0.96) KMT2AMEN1HBBADRA2CCYP2D6
Pseudoephedrine SCHEMBL17004001 0.98 KMT2A (0.96) KMT2AMEN1HBBADRA2CCYP2D6
Racephedrine SCHEMBL8098202 0.98 CYP2D6 (1.00) KMT2AMEN1HBBADRA2CCYP2D6

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6924273-B2 Chondroprotective/restorative compositions and methods of use thereof PIERCE SCOTT W (US) 2005-08-02 — — US claimed
EP-2424363-A1 COMPOSITIONS COMPRISING AN ANTIHISTAMINE, ANTITUSSIVE AND DECONGESTANT IN EXTENDED RELEASE FORMULATIONS Atley Pharmaceuticals, Inc. (US) 2012-03-07 — — EP disclosed
EP-2424534-A2 COMPOSITIONS COMPRISING AN ANTIHISTAMINE, ANTITUSSIVE AND DECONGESTANT IN EXTENDED RELEASE FORMULATIONS Atley Pharmaceuticals, Inc. (US) 2012-03-07 — — EP disclosed
WO-2010127100-A1 COMPOSITIONS COMPRISING AN ANTIHISTAMINE, ANTITUSSIVE AND DECONGESTANT IN EXTENTED RELEASE FORMULATIONS Atley Pharmaceuticals, Inc. (US) 2010-11-04 — — WO disclosed
WO-2010127108-A2 COMPOSITIONS COMPRISING AN ANTIHISTAMINE, ANTITUSSIVE AND DECONGESTANT IN EXTENDED RELEASE FORMULATIONS Atley Pharmaceuticals, Inc. (US) 2010-11-04 — — WO disclosed
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