Ephedrine

Ephedrine

SCHEMBL547932

CN[C@@H](C)[C@H](O)c1ccccc1.O=S(=O)(O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3

The experimentally established mechanism targets of Ephedrine. 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
ADRA2C known ✓ P18825 2/20 0.81
ADRA1A known ✓ P35348 1/20 0.81
ADRA2A known ✓ P08913 1/20 0.47
ALDH1A1 P00352 6/20 1.00
LMNA P02545 4/20 1.00
KDM4E B2RXH2 3/20 1.00
KMT2A Q03164 2/20 1.00
NPSR1 Q6W5P4 2/20 1.00
GMNN O75496 1/20 1.00
POLB P06746 1/20 1.00
MAPT P10636 1/20 1.00
HPGD P15428 1/20 1.00
PMP22 Q01453 1/20 1.00
TDP1 Q9NUW8 1/20 1.00
CYP2D6 P10635 3/20 0.81
CYP2C19 P33261 2/20 0.81
CYP3A4 P08684 2/20 0.81
CHRM2 P08172 1/20 0.81
RGS12 O14924 1/20 0.81
GLA P06280 1/20 0.81

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 SCHEMBL41308 1.00 ALDH1A1 (1.00) ALDH1A1LMNAKDM4EKMT2ANPSR1
Racephedrine SCHEMBL10995708 1.00 ALDH1A1 (1.00) ALDH1A1LMNAKDM4EKMT2ANPSR1
Ephedrine SCHEMBL41262 1.00 ALDH1A1 (1.00) ALDH1A1LMNAKDM4EKMT2ANPSR1
Racephedrine SCHEMBL41264 1.00 ALDH1A1 (1.00) ALDH1A1LMNAKDM4EKMT2ANPSR1
Racephedrine SCHEMBL41263 1.00 ALDH1A1 (1.00) ALDH1A1LMNAKDM4EKMT2ANPSR1
Pseudoephedrine SCHEMBL41309 1.00 ALDH1A1 (1.00) ALDH1A1LMNAKDM4EKMT2ANPSR1
Pseudoephedrine SCHEMBL6229122 0.98 ALDH1A1 (0.96) ALDH1A1LMNAKDM4EKMT2ANPSR1
Racephedrine SCHEMBL6229123 0.98 ALDH1A1 (0.96) ALDH1A1LMNAKDM4EKMT2ANPSR1
Racephedrine SCHEMBL28900784 0.98 ALDH1A1 (0.96) ALDH1A1LMNAKDM4EKMT2ANPSR1
Ephedrine SCHEMBL4785 0.90 CYP2D6 (1.00) ALDH1A1LMNAKDM4EKMT2ANPSR1

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 150 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4057813-A1 COMPOSITIONS AND METHODS FOR TREATING HUANGLONGBING DISEASE IN CITRUS New Life Crop Sciences LLC (US) 2022-09-21 EP claimed
US-20180344743-A1 METHODS OF TREATMENT OF ANORECTAL AND GENITAL DISORDERS PERITECH PHARMA LTD (IL) 2018-12-06 US claimed
US-10085994-B2 Topical compositions and methods of treatment of topical disorders PERITECH PHARMA LTD. (IL) 2018-10-02 US claimed
EP-2968133-A2 TOPICAL COMPOSITIONS AND METHODS OF TREATMENT OF TOPICAL DISORDERS Peritech Pharma Ltd. (IL) 2016-01-20 EP claimed
US-9072747-B2 Topical compositions and methods of treatment of anorectal disorders PERITECH PHARMA LTD. (IL) 2015-07-07 US claimed
WO-2014140925-A2 TOPICAL COMPOSITIONS AND METHODS OF TREATMENT OF TOPICAL DISORDERS PERITECH PHARMA LTD. (IL) 2014-09-18 WO claimed
US-20140255521-A1 TOPICAL COMPOSITIONS AND METHODS OF TREATMENT OF TOPICAL DISORDERS PERITECH PHARMA LTD. (IL) 2014-09-11 US claimed
US-20140256688-A1 TOPICAL COMPOSITIONS AND METHODS OF TREATMENT OF ANORECTAL DISORDERS PERITECH PHARMA LTD. (IL) 2014-09-11 US claimed
US-20140255522-A1 TOPICAL COMPOSITIONS AND METHODS OF TREATMENT OF ANORECTAL AND GENITAL DISORDERS PERITECH PHARMA LTD. (IL) 2014-09-11 US claimed
US-8679535-B2 Sustained release matrix systems for highly soluble drugs ENDO PHARMACEUTICALS INC. (US) 2014-03-25 US claimed
US-20100055185-A1 COMPOSITION AND METHOD FOR TREATING HEMORRHOIDS AND/OR ANORECTAL DISORDERS WYETH (US) 2010-03-04 US claimed
US-20070003627-A1 HEMORRHOIDAL COMPOSITIONS AND METHOD OF USE WYETH (US) 2007-01-04 US claimed
WO-2006014259-A1 COMPOSITION AND METHOD FOR TREATING HEMORRHOIDS AND/OR ANORECTAL DISORDERS WYETH (US) 2006-02-09 WO claimed
US-20060004094-A1 Composition and method for treating hemorrhoids and/or anorectal disorders WYETH 2006-01-05 US claimed
US-20040037888-A1 Hemorrhoidal compositions and method of use WYETH 2004-02-26 US claimed
US-20030035850-A1 HEMORRHOIDAL COMPOSITIONS AND METHOD OF USE WYETH 2003-02-20 US claimed
WO-1998034628-A1 COMPOSITION FOR THE TREATMENT OF HAEMORRHOIDS AND OTHER ANORECTAL INFLAMMATIONS AU PHARMACEUTICALS, INC. (US) 1998-08-13 WO claimed
US-5720962-A Analgesic lotion for hemorrhoids and method of making such lotion AU PHARMACEUTICALS, INC. (US) 1998-02-24 US claimed
EP-0241615-B1 A PHARMACEUTICAL COMPOSITION OF PHENINDAMINE HAVING ENHANCED RELEASE CHARACTERISTICS WARNER-LAMBERT COMPANY (US) 1991-09-18 EP claimed
EP-0241615-A1 A pharmaceutical composition of phenindamine having enhanced release characteristics WARNER-LAMBERT COMPANY (US) 1987-10-21 EP claimed