Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 1/20 | 0.56 |
| ▸ | TRAP1 | Q12931 | 2/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 7/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.43 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.41 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Bromide SCHEMBL286882 | 1.00 | HIF1A (0.56) | HIF1ATRAP1CHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL2446607 | 1.00 | HIF1A (0.56) | HIF1ATRAP1CHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL678415 | 1.00 | HIF1A (0.56) | HIF1ATRAP1CHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL362235 | 1.00 | HIF1A (0.56) | HIF1ATRAP1CHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL1866839 | 1.00 | HIF1A (0.56) | HIF1ATRAP1CHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL7759526 | 1.00 | HIF1A (0.56) | HIF1ATRAP1CHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL635580 | 1.00 | HIF1A (0.56) | HIF1ATRAP1CHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL8775234 | 1.00 | HIF1A (0.56) | HIF1ATRAP1CHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL164301 | 1.00 | HIF1A (0.56) | HIF1ATRAP1CHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL2979400 | 1.00 | HIF1A (0.56) | HIF1ATRAP1CHRNA7ALDH1A1CYP1A2 |
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 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110724042-A | Method for synthesizing sex pheromone active ingredient of populus canula | 中国林业科学研究院森林生态环境与保护研究所 | 2020-01-24 | — | — | CN | claimed |
| US-20100143429-A1 | Contact sex pheromone component of the Emerald Ash Borer Agrilus planipennis Fairmaire (Coleoptera: Buprestidae) | HER MAJESTY THE QUEEN IN RIGHT OF CANADA AS REPRESENTED BY THE MINISTER OF NATURAL RESOURCES CANADA, CANADIAN FOREST SERVICE (CA) | 2010-06-10 | — | — | US | claimed |
| CN-110959613-A | Poplar canula moth sex pheromone attractant composition, lure core and preparation method and application thereof | 中国林业科学研究院森林生态环境与保护研究所 | 2020-04-07 | — | — | CN | disclosed |
| CN-110724042-A | Method for synthesizing sex pheromone active ingredient of populus canula | 中国林业科学研究院森林生态环境与保护研究所 | 2020-01-24 | — | — | CN | disclosed |
| US-9345791-B2 | Ligands for targeting of S1P receptors for in vivo imaging and treatment of diseases | WESTFAELISCHE WILHELMS-UNIVERSITAET MUENSTER (DE) | 2016-05-24 | — | — | US | disclosed |
| US-20160115188-A1 | NOVEL alpha-GALACTOSYL CERAMIDE ANALOGS AND USES THEREOF | CHANG GUNG MEMORIAL HOSPITAL, LINKOU (TW) | 2016-04-28 | — | — | US | disclosed |
| EP-2336144-B1 | ESTERIFIED ALPHA-GALACTOSYLCERAMIDE | RIKEN (JP) | 2015-01-21 | — | — | EP | disclosed |
| EP-2744776-A1 | NEW LIGANDS FOR TARGETING OF S1P RECEPTORS FOR IN VIVO IMAGING AND TREATMENT OF DISEASES | Westfälische Wilhelms-Universität Münster (DE) | 2014-06-25 | — | — | EP | disclosed |
| US-20140170067-A1 | NEW LIGANDS FOR TARGETING OF S1P RECEPTORS FOR IN VIVO IMAGING AND TREATMENT OF DISEASES | WESTFAELISCHE WILHELMS-UNIVERSITAET MUENSTER (DE) | 2014-06-19 | — | — | US | disclosed |
| US-8580751-B2 | Esterified α-galactosylceramide | RIKEN (JP) | 2013-11-12 | — | — | US | disclosed |
| US-8404225-B2 | Contact sex pheromone component of the Emerald Ash Borer Agrilus planipennis Fairmaire (Coleoptera: Buprestidae) | NATIONAL RESEARCH COUNCIL OF CANADA (CA) | 2013-03-26 | — | — | US | disclosed |
| EP-0228045-A2 | Aromatic thioethers | CIBA-GEIGY AG (CH) | 1987-07-08 | — | — | EP | disclosed |
| EP-0121350-B1 | SUBSTITUTED UNSATURATED MERCAPTOCARBOXYLIC ACIDS AND DERIVATIVES AS LEUKOTRIENE ANTAGONISTS | SMITHKLINE BECKMAN CORPORATION (US) | 1987-05-13 | — | — | EP | disclosed |
| US-4649215-A | ANTIALLERGENS | CIBA-GEIGY CORPORATION (US) | 1987-03-10 | — | — | US | disclosed |
| EP-0170048-A2 | Aliphatic thioethers | CIBA-GEIGY AG (CH) | 1986-02-05 | — | — | EP | disclosed |
| EP-0168950-A1 | Leukotriene antagonists | SMITHKLINE BECKMAN CORPORATION (US) | 1986-01-22 | — | — | EP | disclosed |
| US-4552893-A | ASTHMA TREATMENT | SMITHKLINE BECKMAN CORPORATION (US) | 1985-11-12 | — | — | US | disclosed |
| US-4537723-A | Derivatives of leukotrienes A and C | THE UPJOHN COMPANY (US) | 1985-08-27 | — | — | US | disclosed |
| US-4533747-A | ANTIASTHMATICS, ANTIHISTAMINES | SMITHKLINE BECKMAN CORPORATION (US) | 1985-08-06 | — | — | US | disclosed |
| EP-0121350-A2 | Substituted unsaturated mercaptocarboxylic acids and derivatives as leukotriene antagonists | SMITHKLINE BECKMAN CORPORATION (US) | 1984-10-10 | — | — | EP | 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 (3 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.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20100143429-A1 | Contact sex pheromone component of the Emerald Ash Borer Agrilus planipennis Fairmaire (Coleoptera: Buprestidae) | EDNRB, TOE1, CECR2 | HIF1A 4585/4885TRAP1 2277/4885CHRNA7 514/4885 |
| US-20160115188-A1 | NOVEL alpha-GALACTOSYL CERAMIDE ANALOGS AND USES THEREOF | UGCG, CERT1, SGMS1 | HIF1A 1444/4885TRAP1 3403/4885CHRNA7 2385/4885 |
| US-20140170067-A1 | NEW LIGANDS FOR TARGETING OF S1P RECEPTORS FOR IN VIVO IMAGING AND TREATMENT OF DISEASES | S1PR1, S1PR5, S1PR2 | HIF1A 1365/4885TRAP1 1896/4885CHRNA7 2292/4885 |
“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.