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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 known ✓ | P11229 | 3/20 | 0.41 |
| ▸ | CHRM3 known ✓ | P20309 | 3/20 | 0.41 |
| ▸ | CHRM2 known ✓ | P08172 | 2/20 | 0.41 |
| ▸ | CHRM4 known ✓ | P08173 | 2/20 | 0.32 |
| ▸ | CHRM5 known ✓ | P08912 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 8/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 2/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1476239 | 0.98 | TSHR (0.57) | TSHRHPGDALDH1A1TP53HIF1A | |
| Hydrochloric Acid SCHEMBL475768 | 0.96 | TSHR (0.55) | TSHRHPGDALDH1A1TP53HIF1A | |
| Sulfuric Acid SCHEMBL29013316 | 0.91 | TSHR (0.50) | TSHRHPGDALDH1A1TP53HIF1A | |
| Sulfuric Acid SCHEMBL29013317 | 0.90 | TSHR (0.49) | TSHRHPGDALDH1A1TP53HIF1A | |
| Bromide SCHEMBL130775 | 0.89 | TSHR (0.61) | TSHRHPGDALDH1A1TP53HIF1A | |
| SCHEMBL16352906 | 0.89 | TSHR (0.56) | TSHRHPGDALDH1A1TP53HIF1A | |
| Bromide SCHEMBL28358221 | 0.88 | TSHR (0.61) | TSHRHPGDALDH1A1TP53HIF1A | |
| SCHEMBL10609079 | 0.87 | TSHR (0.55) | TSHRHPGDALDH1A1TP53HIF1A | |
| SCHEMBL10882384 | 0.87 | TSHR (0.63) | TSHRHPGDALDH1A1TP53HIF1A | |
| SCHEMBL29106980 | 0.86 | TSHR (0.62) | TSHRHPGDALDH1A1TP53HIF1A |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114524909-B | Ultra-high-strength concrete additive, preparation method thereof and ultra-high-strength concrete | 石家庄市长安育才建材有限公司 | 2022-07-29 | — | — | CN | claimed |
| CN-114524909-A | Ultra-high-strength concrete additive, preparation method thereof and ultra-high-strength concrete | 石家庄市长安育才建材有限公司 | 2022-05-24 | — | — | CN | claimed |
| CN-110745852-B | Preparation method of high-stability polymeric aluminum chloride | 南京工业大学 | 2021-01-12 | — | — | CN | claimed |
| CN-110745852-A | Preparation method of high-stability polymeric aluminum chloride | 南京工业大学 | 2020-02-04 | — | — | CN | claimed |
| CN-114524909-B | Ultra-high-strength concrete additive, preparation method thereof and ultra-high-strength concrete | 石家庄市长安育才建材有限公司 | 2022-07-29 | — | — | CN | disclosed |
| CN-114524909-A | Ultra-high-strength concrete additive, preparation method thereof and ultra-high-strength concrete | 石家庄市长安育才建材有限公司 | 2022-05-24 | — | — | CN | disclosed |
| CN-109789063-B | Personal care gels and methods | 高露洁-棕榄公司 | 2022-01-28 | — | — | CN | disclosed |
| CN-110745852-B | Preparation method of high-stability polymeric aluminum chloride | 南京工业大学 | 2021-01-12 | — | — | CN | disclosed |
| CN-111246821-A | Light absorbing compositions and methods of use | 美国绿阳生物技术及医药公司 | 2020-06-05 | — | — | CN | disclosed |
| EP-3375797-B1 | FILLER POLYESTER, METHOD FOR THEIR PREPARATION AND THEIR USE | KARLSRUHER INST TECHNOLOGIE (DE) | 2020-04-29 | — | — | EP | disclosed |
| CN-110745852-A | Preparation method of high-stability polymeric aluminum chloride | 南京工业大学 | 2020-02-04 | — | — | CN | disclosed |
| US-4158726-A | HIGH MOLECULAR WEIGHT, WATER-SOLUBLE CATIONIC ACRYLIC OR METHACRYLIC ESTER POLYMERS | MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) | 1979-06-19 | — | — | US | disclosed |