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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.66 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | PKM | P14618 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.61 |
| ▸ | GAA | P10253 | 2/20 | 0.60 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL30253474 | 0.98 | SMN1; SMN2 (0.68) | SMN1; SMN2NOTUMALDH1A1KDM4EPOLB | |
| SCHEMBL3089154 | 0.98 | SMN1; SMN2 (0.68) | SMN1; SMN2NOTUMALDH1A1KDM4EPOLB | |
| SCHEMBL25430987 | 0.94 | ALDH1A1 (0.62) | SMN1; SMN2NOTUMALDH1A1KDM4EPOLB | |
| SCHEMBL18793809 | 0.89 | TSHR (0.75) | SMN1; SMN2NOTUMALDH1A1POLBTSHR | |
| SCHEMBL10422954 | 0.88 | TSHR (0.69) | SMN1; SMN2NOTUMALDH1A1KDM4EPOLB | |
| SCHEMBL1545217 | 0.84 | SMN1; SMN2 (0.70) | SMN1; SMN2NOTUMALDH1A1KDM4EPOLB | |
| SCHEMBL342522 | 0.83 | SMN1; SMN2 (0.68) | SMN1; SMN2NOTUMALDH1A1KDM4EPOLB | |
| SCHEMBL14202790 | 0.83 | SMN1; SMN2 (0.68) | SMN1; SMN2NOTUMALDH1A1KDM4EPOLB | |
| SCHEMBL25391399 | 0.83 | SMN1; SMN2 (0.68) | SMN1; SMN2NOTUMALDH1A1KDM4EPOLB | |
| SCHEMBL29520673 | 0.83 | NOTUM (0.69) | SMN1; SMN2NOTUMALDH1A1KDM4EPOLB |
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-5707991-A | TREATMENT OF NERVOUS SYSTEM DISORDERS, PARKINSON'S DISEASE | RHONE-POULENC RORER S.A. (FR) | 1998-01-13 | — | — | US | disclosed |