Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.65 |
| ▸ | HPGD | P15428 | 1/20 | 0.65 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.65 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.65 |
| ▸ | CASP1 | P29466 | 1/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.65 |
| ▸ | MAOA | P21397 | 4/20 | 0.63 |
| ▸ | MAOB | P27338 | 3/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.61 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.61 |
| ▸ | HTR2A | P28223 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.57 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.56 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
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 SCHEMBL11513180 | 0.96 | ALDH1A1 (0.61) | ALDH1A1HPGDALOX15ALOX12CASP1 | |
| Bromide SCHEMBL11532977 | 0.96 | ALDH1A1 (0.61) | ALDH1A1HPGDALOX15ALOX12CASP1 | |
| Bromide SCHEMBL11550987 | 0.96 | ALDH1A1 (0.61) | ALDH1A1HPGDALOX15ALOX12CASP1 | |
| Bromide SCHEMBL9811054 | 0.96 | ALDH1A1 (0.61) | ALDH1A1HPGDALOX15ALOX12CASP1 | |
| Bromide SCHEMBL11283419 | 0.96 | ALDH1A1 (0.61) | ALDH1A1HPGDALOX15ALOX12CASP1 | |
| Bromide SCHEMBL28646960 | 0.96 | ALDH1A1 (0.61) | ALDH1A1HPGDALOX15ALOX12CASP1 | |
| Benzene SCHEMBL3440179 | 0.96 | ALDH1A1 (0.69) | ALDH1A1HPGDALOX15ALOX12CASP1 | |
| SCHEMBL62125 | 0.96 | ALDH1A1 (0.69) | ALDH1A1HPGDALOX15ALOX12CASP1 | |
| SCHEMBL9741303 | 0.96 | ALDH1A1 (0.69) | ALDH1A1HPGDALOX15ALOX12CASP1 | |
| SCHEMBL25402413 | 0.92 | ALDH1A1 (0.65) | ALDH1A1HPGDALOX15ALOX12CASP1 |
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 102 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117362295-A | Cationic molecular cage and preparation method and application thereof | 中山大学 | 2024-01-09 | — | — | CN | claimed |
| CN-109970570-B | Preparation method of p-dibenzyl bromide biquaternary ammonium salt with leukemia cell activity inhibition function | 福建医科大学附属协和医院 | 2022-03-18 | — | — | CN | claimed |
| CN-104974293-B | Cationic polymerization method | 中国石油化工股份有限公司 | 2018-04-10 | — | — | CN | claimed |
| CN-105440231-B | Preparation method of block copolymer and block copolymer | 中国石油化工股份有限公司 | 2018-03-02 | — | — | CN | claimed |
| CN-104974291-B | Cationic polymerization method | 中国石油化工股份有限公司 | 2017-02-15 | — | — | CN | claimed |
| CN-104974290-B | Cationic polymerization method | 中国石油化工股份有限公司 | 2017-01-25 | — | — | CN | claimed |
| CN-104974292-B | Cationic polymerization method | 中国石油化工股份有限公司 | 2017-01-25 | — | — | CN | claimed |
| CN-105111979-B | Environment-friendly type antibiotic fire-retardant TPE carpet back-adhesive powder and preparation method thereof | 安徽雄亚塑胶科技有限公司 | 2016-10-05 | — | — | CN | claimed |
| CN-105713333-A | Food-grade TPE material and preparation technology thereof | 深圳市炫丽塑胶科技有限公司 | 2016-06-29 | — | — | CN | claimed |
| CN-118056833-A | Barbituric acid macrocyclic compound and preparation method and application thereof | 中国科学院化学研究所 | 2024-05-21 | — | — | CN | disclosed |
| CN-117362295-A | Cationic molecular cage and preparation method and application thereof | 中山大学 | 2024-01-09 | — | — | CN | disclosed |
| CN-117247543-A | Cross-linked quaternary ammonium functionalized polyarylethersulfone anion exchange membrane material for water electrolysis hydrogen production and preparation method thereof | 常州大学 | 2023-12-19 | — | — | CN | disclosed |
| CN-116554443-A | Non-conjugated polymer and preparation method and application thereof | 中国科学院福建物质结构研究所 | 2023-08-08 | — | — | CN | disclosed |
| CN-115490724-A | Organic phosphine compound based on cyclophane skeleton and its use | 浙江大学 | 2022-12-20 | — | — | CN | disclosed |
| US-4734458-A | QUATERNIZED POLYAMINES | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1988-03-29 | — | — | US | disclosed |
| EP-0228803-A2 | Ionene elastomers | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1987-07-15 | — | — | EP | disclosed |
| US-4677182-A | COATINGS, ADHESIVES | MINNESOTA MINING AND MANUFACTURING CO. (US) | 1987-06-30 | — | — | US | disclosed |
| US-4152155-A | DRY PROCESSING, HIGH SPEED, NONSILVER PHOTOGRAPHY | EASTMAN KODAK COMPANY (US) | 1979-05-01 | — | — | US | disclosed |
| US-3984441-A | ANTIALLERGENS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) | 1976-10-05 | — | — | US | disclosed |
| US-3941796-A | α-(Hydroxy and alkoxy substituted)phenyl-α-(2-piperidinyl)-methanols | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1976-03-02 | — | — | US | disclosed |