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 | 0.45 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 6/20 | 0.44 |
| ▸ | MGAM | O43451 | 5/20 | 0.44 |
| ▸ | SI | P14410 | 5/20 | 0.44 |
| ▸ | MGAM2 | Q2M2H8 | 5/20 | 0.44 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.43 |
| ▸ | ATR | Q13535 | 1/20 | 0.41 |
| ▸ | COASY | Q13057 | 1/20 | 0.41 |
| ▸ | METAP2 | P50579 | 2/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | COMT | P21964 | 1/20 | 0.41 |
| ▸ | METAP1 | P53582 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4314003 | 0.98 | ACHE (0.46) | ACHEGRIN1GRIN2BGAAMGAM | |
| SCHEMBL3884588 | 0.78 | PARP1 (0.59) | ACHEGRIN1GRIN2BGAAMGAM | |
| SCHEMBL3986301 | 0.78 | ACHE (0.43) | ACHEGRIN1GRIN2BGAAMGAM | |
| SCHEMBL14222708 | 0.78 | NUDT1 (0.51) | ACHEGRIN1GRIN2BGAAMGAM | |
| SCHEMBL8956217 | 0.78 | PSMD14 (0.39) | GRIN1GRIN2BGAAMGAMSI | |
| SCHEMBL9305483 | 0.78 | RAB9A (0.50) | ACHEGRIN1GRIN2BGAAMGAM | |
| SCHEMBL6139625 | 0.78 | MGAM (0.60) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL9533100 | 0.75 | GRIN1 (0.55) | ACHEGRIN1GRIN2BGAAMGAM | |
| Bromide SCHEMBL5141524 | 0.74 | PLAUR (0.53) | GRIN1GRIN2BATRKMT2AKDM4E | |
| SCHEMBL56853 | 0.73 | PARP1 (0.62) | GRIN2BGAAMGAMSIMGAM2 |
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-4131467-A | 4,7-Dihydroxybenzimidazole hydrobromide as antifogger | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1978-12-26 | — | — | US | disclosed |