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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.92 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.92 |
| ▸ | ESR1 | P03372 | 4/20 | 0.63 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CA3 | P07451 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
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 SCHEMBL64728 | 1.00 | TDP1 (0.92) | TDP1CYP3A4ESR1ESR2KDM4E | |
| Bromide SCHEMBL28046864 | 1.00 | TDP1 (0.92) | TDP1CYP3A4ESR1ESR2KDM4E | |
| Bromide SCHEMBL64729 | 1.00 | TDP1 (0.92) | TDP1CYP3A4ESR1ESR2KDM4E | |
| Bromide SCHEMBL3314443 | 1.00 | TDP1 (0.92) | TDP1CYP3A4ESR1ESR2KDM4E | |
| Bromide SCHEMBL1409549 | 1.00 | TDP1 (0.92) | TDP1CYP3A4ESR1ESR2KDM4E | |
| Bromide SCHEMBL71504 | 1.00 | TDP1 (0.92) | TDP1CYP3A4ESR1ESR2KDM4E | |
| Bromide SCHEMBL1409552 | 1.00 | TDP1 (0.92) | TDP1CYP3A4ESR1ESR2KDM4E | |
| Bromide SCHEMBL10792875 | 0.96 | TDP1 (0.86) | TDP1CYP3A4ESR1ESR2KDM4E | |
| Bromide SCHEMBL1069060 | 0.96 | TDP1 (0.86) | TDP1CYP3A4ESR1ESR2KDM4E | |
| Bromide SCHEMBL9510236 | 0.96 | TDP1 (0.86) | TDP1CYP3A4ESR1ESR2KDM4E |
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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114653344-B | Triazole gel material, preparation method thereof and application thereof in adsorbing organic pollutants | 中山大学 | 2024-01-09 | — | — | CN | claimed |
| CN-115043788-B | Trifluoromethyl oxazol-2-one compound and preparation method and application thereof | 南京工业大学 | 2023-10-20 | — | — | CN | claimed |
| CN-116731662-A | High-viscosity high-temperature-resistant dimer acid type polyamide hot melt adhesive and preparation method thereof | 上海长园电子材料有限公司 | 2023-09-12 | — | — | CN | claimed |
| CN-115043788-A | Trifluoromethyl oxazole-2-ketone compound and preparation method and application thereof | 南京工业大学 | 2022-09-13 | — | — | CN | claimed |
| CN-113603662-A | Method for preparing 4- (1-ketone-2-propargyl phenyl propane) phthalic anhydride | 陕西泰合利华工业有限公司 | 2021-11-05 | — | — | CN | claimed |
| CN-113511991-A | Synthesis method for thioatherification and thiocarbonylation of halogenated alkane | 安徽农业大学 | 2021-10-19 | — | — | CN | claimed |
| CN-113173830-A | Synthesis method of 1, 1-difluoro-2-propylene hydrocarbon compound | 合肥工业大学 | 2021-07-27 | — | — | CN | claimed |
| CN-112574148-A | Preparation method of 4,4'- (4,4' -isopropylidenediphenoxy) bis (phthalic anhydride) | 天津市众泰化工科技有限公司 | 2021-03-30 | — | — | CN | claimed |
| CN-112358388-A | All-carbon spiro-condensed polycyclic compound and preparation method thereof | 南京林业大学 | 2021-02-12 | — | — | CN | claimed |
| CN-112321487-A | Polysubstituted isoindoline compound and preparation method thereof | 南京林业大学 | 2021-02-05 | — | — | CN | claimed |
| CN-112010744-A | Farnesyl acetone and preparation method thereof | 武汉臻智生物科技有限公司 | 2020-12-01 | — | — | CN | claimed |
| CN-111454286-A | Synthetic method of difluoroalkenyl boron compound | 合肥工业大学 | 2020-07-28 | — | — | CN | claimed |
| CN-111423304-A | Synthesis method of 1, 1-difluoroolefin compound | 合肥工业大学 | 2020-07-17 | — | — | CN | claimed |
| CN-111349205-A | Fluoropolymer adhesive and method | 波音公司 | 2020-06-30 | — | — | CN | claimed |
| CN-118453833-A | Nanoparticle for safely carrying and accurately releasing melittin through light control and anti-tumor application of nanoparticle | 江南大学 | 2024-08-09 | — | — | CN | disclosed |
| CN-115043788-B | Trifluoromethyl oxazol-2-one compound and preparation method and application thereof | 南京工业大学 | 2023-10-20 | — | — | CN | disclosed |
| CN-116731662-A | High-viscosity high-temperature-resistant dimer acid type polyamide hot melt adhesive and preparation method thereof | 上海长园电子材料有限公司 | 2023-09-12 | — | — | CN | disclosed |
| WO-2012020227-A1 | TRICYCLIC COMPOUNDS FOR USE AS KINASE INHIBITORS | CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS (CNIO) (ES) | 2012-02-16 | — | — | WO | disclosed |
| WO-2011095625-A1 | 1,2,4-TRIAZINE-4-AMINE DERIVATIVES | HEPTARES THERAPEUTICS LIMITED (GB) | 2011-08-11 | — | — | WO | disclosed |
| US-20080319244-A1 | Method for the Production of (E,Z)-7,8-Cyclohexadecene-1-one | SYMRISE GMBH & CO. KG (DE) | 2008-12-25 | — | — | 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.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20080319244-A1 | Method for the Production of (E,Z)-7,8-Cyclohexadecene-1-one | CYP8B1, CYP51A1, CYP2A7 | ACHE 2020/4885TDP1 3234/4885CYP3A4 145/4885 |
“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.