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 | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 4/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 4/20 | 0.42 |
| ▸ | BTK | Q06187 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | DCUN1D1 | Q96GG9 | 3/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | ADK | P55263 | 1/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4950 | 0.98 | NR1H2 (0.43) | NR1H2NR1H3BTKCYP1A2KDM4E | |
| Bromide SCHEMBL27863912 | 0.96 | NR1H2 (0.39) | NR1H2NR1H3BTKCYP1A2KDM4E | |
| SCHEMBL28994299 | 0.95 | NR1H2 (0.42) | NR1H2NR1H3BTKCYP1A2KDM4E | |
| SCHEMBL29402664 | 0.95 | NR1H2 (0.42) | NR1H2NR1H3BTKCYP1A2KDM4E | |
| SCHEMBL2954445 | 0.95 | NR1H2 (0.42) | NR1H2NR1H3BTKCYP1A2KDM4E | |
| Water SCHEMBL7382263 | 0.95 | NR1H2 (0.42) | NR1H2NR1H3BTKCYP1A2KDM4E | |
| SCHEMBL10635278 | 0.95 | NR1H2 (0.42) | NR1H2NR1H3BTKCYP1A2KDM4E | |
| Selenium SCHEMBL30289776 | 0.95 | NR1H2 (0.42) | NR1H2NR1H3BTKCYP1A2KDM4E | |
| SCHEMBL22498864 | 0.95 | NR1H2 (0.42) | NR1H2NR1H3BTKCYP1A2KDM4E | |
| SCHEMBL3962514 | 0.95 | NR1H2 (0.42) | NR1H2NR1H3BTKCYP1A2KDM4E |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5110745-A | Methods of detecting glycated proteins | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1992-05-05 | — | — | US | claimed |
| CN-112138030-A | Effective component of phellinus igniarius for preventing and treating gout, preparation method and application | 淳安千岛湖桑都食用菌专业合作社 | 2020-12-29 | — | — | CN | disclosed |
| CN-104418833-B | Antimycin analog and its preparation method and application | 中国科学院上海有机化学研究所 | 2019-06-28 | — | — | CN | disclosed |
| CN-109364256-A | A kind of agarose micella pharmaceutical carrier | 广西科学院 | 2019-02-22 | — | — | CN | disclosed |
| CN-109134573-A | A kind of lumistane type steroidal compounds, preparation method and the usage | 中国科学院上海药物研究所 | 2019-01-04 | — | — | CN | disclosed |
| CN-109071435-A | Indoline derivative object includes their compositions and application thereof | 耶路撒冷希伯来大学伊森姆研究发展公司 | 2018-12-21 | — | — | CN | disclosed |
| CN-108697771-A | Cancer treatment | 普罗潘克股份有限公司 | 2018-10-23 | — | — | CN | disclosed |
| CN-105902533-B | Purposes of the compound cercosporamide in immunopotentiator is prepared | 浙江省医学科学院 | 2018-04-20 | — | — | CN | disclosed |
| CN-107198684-A | Application of luteolin in preparation of medicine for treating oxidative stress injury of testicular tissue | 南京工业大学 | 2017-09-26 | — | — | CN | disclosed |
| CN-104497171-B | Hyaluronic-acid-based amphiphilic polymer as well as preparation method and application thereof | 博瑞生物医药（苏州）股份有限公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-104769011-B | Branched polyamines for delivery of bioactive materials | 囯际商业机器公司 | 2017-04-19 | — | — | CN | disclosed |
| CN-1374316-A | Macrocyclic target specific antisense nucleic acid compound | WVIJIN CO LTD (KR) | 2002-10-16 | — | — | CN | disclosed |
| CN-1285818-A | Compounds for antemortem diagnosis and in vivo imaging of alzheimer's disease and prevention of amyloid deposition | UNIV PITTSBURGH (US) | 2001-02-28 | — | — | CN | disclosed |
| EP-0855911-A4 | NAMENAMICIN, AN ENEDIYNE ANTITUMOR ANTIBIOTIC FROM THE MARINE ASCIDIAN POLYSYNCRATON LITHOSTROTUM | UNIV UTAH RES FOUND (US) | 1998-10-14 | — | — | EP | disclosed |
| EP-0855911-A1 | NAMENAMICIN, AN ENEDIYNE ANTITUMOR ANTIBIOTIC FROM THE MARINE ASCIDIAN POLYSYNCRATON LITHOSTROTUM | UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) | 1998-08-05 | — | — | EP | disclosed |
| WO-1997014421-A1 | NAMENAMICIN, AN ENEDIYNE ANTITUMOR ANTIBIOTIC FROM THE MARINE ASCIDIAN POLYSYNCRATON LITHOSTROTUM | UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) | 1997-04-24 | — | — | WO | disclosed |
| US-5110745-A | Methods of detecting glycated proteins | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1992-05-05 | — | — | US | disclosed |