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 | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL31302316 | 0.98 | TTR (0.50) | TTRLMNARAB9AHTTMAPK1 | |
| SCHEMBL104151 | 0.98 | TTR (0.50) | TTRLMNARAB9AHTTMAPK1 | |
| Hydrochloric Acid SCHEMBL6520005 | 0.96 | TTR (0.48) | TTRLMNARAB9AHTTMAPK1 | |
| Fluoride SCHEMBL11181401 | 0.96 | TTR (0.48) | TTRLMNARAB9AHTTMAPK1 | |
| Trichloroacetic Acid SCHEMBL7814387 | 0.87 | TTR (0.41) | TTRLMNARAB9AHTTMAPK1 | |
| SCHEMBL30817696 | 0.83 | ALDH1A1 (0.52) | RAB9APGRTSHRCA1CA2 | |
| SCHEMBL10884738 | 0.82 | CES2 (0.52) | TTRRAB9APGRCES2CES1 | |
| SCHEMBL10555693 | 0.81 | CES2 (0.45) | RAB9APGRCA1CA2CES2 | |
| SCHEMBL286942 | 0.81 | HTT (0.53) | TTRLMNARAB9AHTTMAPK1 | |
| SCHEMBL9215548 | 0.81 | NPC1 (0.47) | RAB9APGRCA1CA2CES2 |
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-4383949-A | Preparation of 3-bromo-4-fluorobenzaldehyde and its acetals | BAYER AKTIENGESELLSCHAFT (DE) | 1983-05-17 | — | — | US | disclosed |