Atropine

Atropine

SCHEMBL249586

CN1[C@@H]2CC[C@H]1C[C@H](OC(=O)[C@H](CO)c1ccccc1)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CHRM1CHRM2CHRM3

The experimentally established mechanism targets of Atropine. 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
CHRM1 known ✓ P11229 5/20 1.00
CHRM2 known ✓ P08172 5/20 1.00
CHRM3 known ✓ P20309 4/20 1.00
CHRM5 P08912 4/20 1.00
CHRM4 P08173 4/20 1.00
LMNA P02545 3/20 1.00
HTR2C P28335 2/20 1.00
BLM P54132 2/20 1.00
NFKB1 P19838 2/20 1.00
KMT2A Q03164 2/20 1.00
KDM4E B2RXH2 1/20 1.00
MEN1 O00255 1/20 1.00
POLB P06746 1/20 1.00
ADRA2C P18825 1/20 1.00
ADRA1A P35348 1/20 1.00
HRH1 P35367 1/20 1.00
SLC22A1 O15245 1/20 1.00
ADRA1D P25100 1/20 1.00
MAPT P10636 1/20 0.91
ALDH1A1 P00352 1/20 0.88

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
Hyoscyamine SCHEMBL41316 1.00 CHRM1 (1.00) CHRM1CHRM2CHRM5CHRM3CHRM4
Atropine SCHEMBL41317 1.00 CHRM1 (1.00) CHRM1CHRM2CHRM5CHRM3CHRM4
Atropine SCHEMBL17775090 1.00 CHRM1 (1.00) CHRM1CHRM2CHRM5CHRM3CHRM4
Atropine SCHEMBL2728129 1.00 CHRM1 (1.00) CHRM1CHRM2CHRM5CHRM3CHRM4
Atropine SCHEMBL14946873 1.00 CHRM1 (1.00) CHRM1CHRM2CHRM5CHRM3CHRM4
Atropine SCHEMBL8854381 1.00 CHRM1 (1.00) CHRM1CHRM2CHRM5CHRM3CHRM4
Atropine SCHEMBL7941966 1.00 CHRM1 (1.00) CHRM1CHRM2CHRM5CHRM3CHRM4
Atropine SCHEMBL25020 1.00 CHRM1 (1.00) CHRM1CHRM2CHRM5CHRM3CHRM4
Atropine SCHEMBL2812 1.00 CHRM1 (1.00) CHRM1CHRM2CHRM5CHRM3CHRM4
Hyoscyamine SCHEMBL4957671 1.00 CHRM1 (1.00) CHRM1CHRM2CHRM5CHRM3CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118453493-A D2O-stabilized pharmaceutical formulations 西德奈克西斯公司 2024-08-09 CN claimed
CN-113968853-B Hapten and artificial antigen of atropine alkaloid, and preparation method and application thereof 中国农业大学 2022-09-16 CN claimed
CN-113968853-A Hapten and artificial antigen of atropine alkaloid, and preparation method and application thereof 中国农业大学 2022-01-25 CN claimed
WO-2019155389-A1 AN AQUEOUS MUCOADHESIVE AND BIOADHESIVE COMPOSITION FOR THE TREATMENT TARGET ONCOLOGY INC. (US) 2019-08-15 WO claimed
WO-2018189484-A1 MATRIX FOR SPECIFIC DETECTION OF ALKALOIDS BY MALDI-TOF MASS SPECTROMETRY Université d'Angers (FR) 2018-10-18 WO claimed
US-9155731-B1 Methods of non-gastrointestinal endoscopic procedures using L-hyoscyamine oral formulations TRUIST BANK, AS ADMINISTRATIVE AGENT 2015-10-13 US claimed
EP-2734514-B1 USE OF A THIOPHENE COMPOUND AS A MATRIX IN THE SPECIFIC DETECTION, IDENTIFICATION AND/OR QUANTIFICATION OF ALKALOIDS BY MALDI-TOF MASS SPECTROMETRY UNIV ANGERS (FR) 2015-07-08 EP claimed
US-8946258-B1 Methods of non-gastrointestinal endoscopic procedures using L-hyoscyamine oral formulations TRUIST BANK, AS ADMINISTRATIVE AGENT 2015-02-03 US claimed
US-20140319331-A1 NEW USE FOR A COMPOUND AS A MATRIX IN THE SPECIFIC DETECTION, IDENTIFICATION AND/OR QUANTIFICATION OF ALKALOIDS BY MALDI-TOF MASS SPECTROMETRY CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE CNRS (FR) 2014-10-30 US claimed
EP-2734514-A1 NEW USE FOR A COMPOUND AS A MATRIX IN THE SPECIFIC DETECTION, IDENTIFICATION AND/OR QUANTIFICATION OF ALKALOIDS BY MALDI-TOF MASS SPECTROMETRY Centre National de la Recherche Scientifique (CNRS) (FR) 2014-05-28 EP claimed
CN-101203250-A Methods and compositions for the delivery of biologically active agents INTERFACE BIOLOGICS INC (CA) 2008-06-18 CN claimed
EP-1868664-A2 METHODS AND COMPOSITIONS FOR THE DELIVERY OF BIOLOGICALLY ACTIVE AGENTS Interface Biologics Inc. (CA) 2007-12-26 EP claimed
EP-1844158-A2 BIOMARKER FOR INFLAMMATORY BOWEL DISEASE THE JOHNS-HOPKINS UNIVERSITY (US) 2007-10-17 EP claimed
US-20070037891-A1 Methods and compositions for the delivery of biologically active agents INTERFACE BIOLOGICS (CA) 2007-02-15 US claimed
WO-2007004067-A2 METHODS AND COMPOSITIONS FOR THE DELIVERY OF BIOLOGICALLY ACTIVE AGENTS INTERFACE BIOLOGICS INC. (CA) 2007-01-11 WO claimed
WO-2006063133-A2 BIOMARKER FOR INFLAMMATORY BOWEL DISEASE THE JOHNS HOPKINS UNIVERSITY (US) 2006-06-15 WO claimed
CN-1492761-A Injectable pharmaceutical composition for treatment and reversal of erectile dysfunction 美国医疗产品公司 2004-04-28 CN claimed
WO-2002069966-A1 INJECTABLE PHARMACEUTICAL COMPOSITION FOR TREATMENT AND REVERSAL OF ERECTILE DYSFUNCTION USA DOCTORS PRODUCTS, INC. (US) 2002-09-12 WO claimed
US-6197801-B1 MIXTURE OF PROSTAGLANDIN E-1, LEVSIN, 6,7-DIMETHOXY-1-VERATYLISOQUINOLOINE HYDROCHLORIDE, DILTIAZEM HCL AND CHLORPROMAZINE USA DOCTORS PRODUCTS, INC. 2001-03-06 US claimed
US-4591573-A REACTING L-HYOSCYAMINE WITH DIAZOTIZED P-AMINOBENZOIC ACID TO PRODUCE HAPTEN THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1986-05-27 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140319331-A1 NEW USE FOR A COMPOUND AS A MATRIX IN THE SPECIFIC DETECTION, IDENTIFICATION AND/OR QUANTIFICATION OF ALKALOIDS BY MALDI-TOF MASS SPECTROMETRY CIAPIN1, SRMS, MMP7 CHRM1 1582/4885CHRM2 1237/4885CHRM3 768/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.