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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.64 |
| ▸ | CES1 | P23141 | 2/20 | 0.64 |
| ▸ | MAOB | P27338 | 1/20 | 0.62 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.55 |
| ▸ | GSK3B | P49841 | 2/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.53 |
| ▸ | P2RY14 | Q15391 | 2/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.50 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | DHODH | Q02127 | 1/20 | 0.49 |
| ▸ | KIF11 | P52732 | 2/20 | 0.48 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.48 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.48 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL171651 | 0.98 | CES2 (0.67) | CES2CES1MAOBSRD5A2GSK3B | |
| Hydrochloric Acid SCHEMBL8491584 | 0.95 | CES2 (0.64) | CES2CES1MAOBSRD5A2GSK3B | |
| Water SCHEMBL27804326 | 0.95 | CES2 (0.64) | CES2CES1MAOBSRD5A2GSK3B | |
| Hydrochloric Acid SCHEMBL4376063 | 0.95 | CES2 (0.64) | CES2CES1MAOBSRD5A2GSK3B | |
| Benzene SCHEMBL28007808 | 0.93 | CES2 (0.61) | CES2CES1MAOBSRD5A2GSK3B | |
| SCHEMBL5429632 | 0.91 | P2RY14 (0.60) | CES2CES1MAOBSRD5A2GSK3B | |
| Hydrochloric Acid SCHEMBL30116623 | 0.90 | P2RY14 (0.58) | CES2CES1MAOBSRD5A2GSK3B | |
| SCHEMBL22721339 | 0.86 | CYP1A2 (0.59) | CES2CES1MAOBPTGS1 | |
| SCHEMBL22721356 | 0.86 | MAOB (0.67) | CES2CES1MAOBSRD5A2GSK3B | |
| SCHEMBL22721407 | 0.86 | MAOB (0.58) | CES2CES1MAOBSRD5A2GSK3B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114864840-B | Preparation method of blue light perovskite light-emitting diode | 上海大学 | 2024-06-18 | — | — | CN | disclosed |
| CN-114864840-B | Preparation method of blue light perovskite light-emitting diode | 上海大学 | 2024-06-18 | — | — | CN | disclosed |
| CN-114864840-A | Preparation method of blue-light perovskite light-emitting diode | 上海大学 | 2022-08-05 | — | — | CN | disclosed |
| CN-114864840-A | Preparation method of blue-light perovskite light-emitting diode | 上海大学 | 2022-08-05 | — | — | CN | disclosed |