Ipratropium

Ipratropium

SCHEMBL99101

Br.CC(C)[N+]1(C)C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2

nearest known ligand 0.98

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CHRM3

The experimentally established mechanism targets of Ipratropium. 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
CHRM3 known ✓ P20309 6/20 0.98
CHRM2 P08172 7/20 0.98
CHRM5 P08912 6/20 0.98
CHRM1 P11229 6/20 0.98
CHRM4 P08173 5/20 0.98
MEN1 O00255 3/20 0.98
KMT2A Q03164 3/20 0.98
TSHR P16473 2/20 0.98
SMN1; SMN2 Q16637 2/20 0.93
BLM P54132 4/20 0.77
PABPC1 P11940 1/20 0.77
CYP2C19 P33261 1/20 0.75
CYP3A4 P08684 1/20 0.64
CYP2C9 P11712 1/20 0.64
HIF1A Q16665 1/20 0.64
HSD17B10 Q99714 1/20 0.64
HTR2C P28335 2/20 0.62
KDM4E B2RXH2 1/20 0.62
LMNA P02545 1/20 0.62
POLB P06746 1/20 0.62

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
Ipratropium SCHEMBL27539194 1.00 CHRM2 (0.98) CHRM2CHRM5CHRM1CHRM3CHRM4
Ipratropium SCHEMBL22467689 1.00 CHRM2 (0.98) CHRM2CHRM5CHRM1CHRM3CHRM4
Ipratropium SCHEMBL19211133 1.00 CHRM2 (0.98) CHRM2CHRM5CHRM1CHRM3CHRM4
Ipratropium SCHEMBL7678599 0.99 CHRM2 (0.95) CHRM2CHRM5CHRM1CHRM3CHRM4
Ipratropium SCHEMBL22077028 0.99 CHRM2 (0.96) CHRM2CHRM5CHRM1CHRM3CHRM4
Ipratropium SCHEMBL25298399 0.99 CHRM2 (0.95) CHRM2CHRM5CHRM1CHRM3CHRM4
Ipratropium SCHEMBL6553359 0.99 CHRM2 (0.95) CHRM2CHRM5CHRM1CHRM3CHRM4
Ipratropium SCHEMBL8442770 0.99 CHRM2 (0.96) CHRM2CHRM5CHRM1CHRM3CHRM4
Ipratropium SCHEMBL99102 0.99 CHRM2 (0.96) CHRM2CHRM5CHRM1CHRM3CHRM4
Ipratropium SCHEMBL17271494 0.99 CHRM2 (0.96) CHRM2CHRM5CHRM1CHRM3CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9072734-B2 Quaternary ammonium salt compounds TEIJIN PHARMA LIMITED (JP) 2015-07-07 US disclosed
EP-2426121-A1 QUATERNARY AMMONIUM SALT COMPOUND Teijin Pharma Limited (JP) 2012-03-07 EP disclosed
US-20120046467-A1 QUATERNARY AMMONIUM SALT COMPOUNDS TEIJIN PHARMA LIMITED (JP) 2012-02-23 US disclosed

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-20120046467-A1 QUATERNARY AMMONIUM SALT COMPOUNDS ADRB2, AGTR2, ADRB3 CHRM3 9/4885CHRM2 15/4885CHRM5 20/4885

“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.