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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 SCHEMBL2244872 | 0.95 | — | — | |
| SCHEMBL1334882 | 0.95 | — | — | |
| Iodide SCHEMBL7534333 | 0.90 | — | — | |
| Fluoride SCHEMBL6229645 | 0.90 | — | — | |
| Bromide SCHEMBL28639605 | 0.90 | ALDH1A1 (0.33) | — | |
| Bromide SCHEMBL2831146 | 0.90 | ALDH1A1 (0.33) | — | |
| Fluoride Ion SCHEMBL963997 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL691818 | 0.90 | — | — | |
| Fluoride SCHEMBL1263596 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL29118970 | 0.90 | — | — |
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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109096149-B | Process for the preparation of beta-arylamines | 富兰克科技（深圳）股份有限公司 | 2021-02-26 | — | — | CN | claimed |
| CN-109096149-A | The preparation method of β arylamine | 富兰克科技（深圳）股份有限公司 | 2018-12-28 | — | — | CN | claimed |
| CN-105566366-B | One-step method prepares double（Di alkylamino group）The technique of halogenation boron | 沧州普瑞东方科技有限公司 | 2017-08-15 | — | — | CN | claimed |
| CN-113354601-A | Preparation method of beta-propiolactone | 国药集团化学试剂有限公司 | 2021-09-07 | — | — | CN | disclosed |
| CN-109096149-B | Process for the preparation of beta-arylamines | 富兰克科技（深圳）股份有限公司 | 2021-02-26 | — | — | CN | disclosed |
| US-10799441-B2 | Skin treatments containing pyrroloquinoline quinone (PQQ) esters and methods of preparation and use thereof | PCR TECHNOLOGY HOLDINGS, LC (US) | 2020-10-13 | — | — | US | disclosed |
| CN-109096149-A | The preparation method of β arylamine | 富兰克科技（深圳）股份有限公司 | 2018-12-28 | — | — | CN | disclosed |
| CN-105566366-B | One-step method prepares double（Di alkylamino group）The technique of halogenation boron | 沧州普瑞东方科技有限公司 | 2017-08-15 | — | — | CN | disclosed |
| CN-105152852-B | Preparation method of 1-bromo-1-chloro-2,2-difluoroethylene | 湖南城市学院 | 2017-05-10 | — | — | CN | disclosed |
| CN-105566366-A | One-step preparation technology of bis(dialkylamino)boron halide | CANGZHOU PURUI DONGFANG SCIENCE & TECH CO LTD | 2016-05-11 | — | — | CN | disclosed |
| CN-105152852-A | Preparation method of 1-bromo-1-chloro-2,2-difluoroethylene | UNIV HUNAN CITY | 2015-12-16 | — | — | CN | disclosed |
| CN-1956742-A | Absorbable biocompatible materials | BIOINTERACTIONS LTD (GB) | 2007-05-02 | — | — | CN | disclosed |
| CN-1283600-C | Preparation of 1,3-diacetylene benzene | UNIV EAST CHINA SCIENCE & TECH (CN) | 2006-11-08 | — | — | CN | disclosed |
| CN-1680229-A | Preparation of 1,3-diacetylene benzene | HUADONG SCIENCE & ENGINEERING (CN) | 2005-10-12 | — | — | CN | disclosed |
| EP-1019407-B1 | METALLO-PORPHYRINS | QINETIQ LTD (GB) | 2003-08-20 | — | — | EP | disclosed |
| CN-1078889-C | Non-peptide tachykinin receptor antagonists | LILLY CO ELI (US) | 2002-02-06 | — | — | CN | disclosed |
| CN-1298377-A | Preparation of polyindanebisphenols and polymers derived therefrom | ALLIED SIGNAL INC (US) | 2001-06-06 | — | — | CN | disclosed |
| US-6235895-B1 | MONOMERIC OR OLIGOMERIC METALLO-PORPHYRIN DERIVATIVES HAVING MESO-ALKYNYL SUBSTITUENTS. | THE SECRETARY OF STATE FOR DEFENCE (GB) | 2001-05-22 | — | — | US | disclosed |
| CN-1141043-A | Non-peptide tachykinin receptor antagonists | LILLY CO ELI (US) | 1997-01-22 | — | — | CN | disclosed |
| CN-86105080-A | Luminescence method Synthetic 2-chloro-8-ethyl-5-oxygen-5, and the 8-dihydropyridine (2,3-d) parallel pyrimidine-6-alkyl carboxylates technology | — | 1987-02-11 | — | — | CN | disclosed |