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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | XDH | P47989 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | FNTA | P49354 | 1/20 | 0.33 |
| ▸ | FNTB | P49356 | 1/20 | 0.33 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7263458 | 0.81 | TAAR1 (0.34) | TAAR1HTR1AKDM4EALDH1A1AOC3 | |
| Hydrochloric Acid SCHEMBL7744211 | 0.77 | TAAR1 (0.44) | TAAR1HTR1A | |
| Bromide SCHEMBL6435571 | 0.73 | FDPS (0.44) | TAAR1HTR1AKDM4EALDH1A1CYP3A4 | |
| SCHEMBL3515192 | 0.73 | FNTA (0.40) | KDM4ECYP3A4FNTAFNTBPGGT1B | |
| Bromide SCHEMBL6409244 | 0.72 | DAO (0.42) | XDH | |
| SCHEMBL6432861 | 0.72 | FDPS (0.45) | TAAR1HTR1AKDM4EALDH1A1CYP3A4 | |
| SCHEMBL6432281 | 0.70 | DAO (0.42) | XDH | |
| Bromide SCHEMBL8005948 | 0.70 | NTRK1 (0.36) | ALDH1A1XDH | |
| SCHEMBL25170808 | 0.69 | NOS3 (0.42) | ALDH1A1XDHCYP3A4NPC1RAB9A | |
| SCHEMBL1507905 | 0.66 | TAAR1 (0.61) | TAAR1HTR1AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001017992-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 2001-03-15 | — | — | WO | disclosed |