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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 4/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.33 |
| ▸ | DNMT3B | Q9UBC3 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KLKB1 | P03952 | 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 | |
|---|---|---|---|---|
| SCHEMBL27709504 | 0.98 | ROCK2 (0.39) | ROCK2ROCK1MAPK14BACE1MEN1 | |
| Hydrochloric Acid SCHEMBL3658158 | 0.96 | ROCK2 (0.38) | ROCK2ROCK1MAPK14BACE1MEN1 | |
| SCHEMBL3658658 | 0.76 | CYP1A2 (0.41) | ROCK2ROCK1BACE1KMT2AGAA | |
| SCHEMBL2814423 | 0.74 | MAPT (0.36) | MEN1KMT2ANPC1P2RX7HTT | |
| Hydrochloric Acid SCHEMBL17707535 | 0.74 | HTT (0.42) | ROCK2ROCK1BACE1GAANPC1 | |
| SCHEMBL17198841 | 0.73 | BACE1 (0.41) | ROCK2ROCK1MAPK14BACE1MEN1 | |
| Bromide SCHEMBL2811699 | 0.72 | ALDH1A1 (0.50) | MEN1KMT2APOLB | |
| SCHEMBL3557822 | 0.72 | CYP1A2 (0.48) | ROCK2ROCK1MAPK14MEN1KMT2A | |
| Bromide SCHEMBL4918498 | 0.72 | MEN1 (0.37) | MEN1KMT2AGAANPC1 | |
| Bromide SCHEMBL2810282 | 0.71 | NPC1 (0.39) | MEN1KMT2AGAANPC1HTT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070015805-A1 | Process for preparing 3-arylmethylthio- and 3-heteroarylmethylthio-4,5-dihydroisoxazoline derivatives | BAYER CROPSCIENCE GMBH (DE) | 2007-01-18 | — | — | 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-20070015805-A1 | Process for preparing 3-arylmethylthio- and 3-heteroarylmethylthio-4,5-dihydroisoxazoline derivatives | CYP3A7, KMO, CYP4X1 | ROCK2 3833/4885ROCK1 3659/4885MAPK14 2109/4885 |
“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.