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 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MC4R | P32245 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL7019712 | 0.79 | SIGMAR1 (0.33) | SIGMAR1KDM4EKMT2AMEN1ALDH1A1 | |
| Bromide SCHEMBL27466671 | 0.79 | LMNA (0.40) | SIGMAR1KDM4EKMT2AMEN1MC4R | |
| SCHEMBL28223634 | 0.78 | LMNA (0.37) | SIGMAR1KDM4EKMT2AMEN1MC4R | |
| SCHEMBL25379874 | 0.77 | LMNA (0.41) | SIGMAR1KDM4EMC4RALDH1A1LMNA | |
| SCHEMBL28261453 | 0.76 | SIGMAR1 (0.49) | SIGMAR1KDM4EKMT2AALDH1A1LMNA | |
| Bromide SCHEMBL29099290 | 0.76 | MAPT (0.41) | KMT2AMEN1ALDH1A1LMNAGAA | |
| Bromide SCHEMBL29099282 | 0.76 | SIGMAR1 (0.38) | SIGMAR1KMT2AMC4RALDH1A1LMNA | |
| Bromide SCHEMBL28711468 | 0.74 | SIGMAR1 (0.37) | SIGMAR1KDM4EKMT2AMC4RALDH1A1 | |
| SCHEMBL8804597 | 0.73 | SIGMAR1 (0.39) | SIGMAR1KDM4EMC4RALDH1A1LMNA | |
| SCHEMBL27763000 | 0.73 | SIGMAR1 (0.39) | SIGMAR1KMT2AMEN1MC4R |
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 |
|---|---|---|---|---|---|---|---|
| CN-116803980-A | Preparation method of tetrahydropyridine derivative and hexahydropyridine derivative | 中国科学院化学研究所 | 2023-09-26 | — | — | CN | disclosed |