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 | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.56 |
| ▸ | HPGD | P15428 | 5/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | TSHR | P16473 | 4/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 2/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.52 |
| ▸ | CA4 | P22748 | 1/20 | 0.52 |
| ▸ | CA6 | P23280 | 1/20 | 0.52 |
| ▸ | CA7 | P43166 | 1/20 | 0.52 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.52 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL4014026 | 0.98 | KDM4E (0.58) | KDM4EHPGDMAPTTSHRALDH1A1 | |
| SCHEMBL27533876 | 0.84 | ALDH1A1 (0.46) | KDM4EHPGDMAPTTSHRALDH1A1 | |
| SCHEMBL10788497 | 0.83 | CYP19A1 (0.59) | KDM4EHPGDMAPTTSHRALDH1A1 | |
| SCHEMBL14645922 | 0.81 | ALOX5 (0.50) | KDM4EHPGDMAPTTSHRALDH1A1 | |
| SCHEMBL31211720 | 0.79 | CYP19A1 (0.66) | KDM4EHPGDMAPTTSHRALDH1A1 | |
| SCHEMBL598345 | 0.79 | MEN1 (0.69) | KDM4EHPGDMAPTTSHRALDH1A1 | |
| SCHEMBL105808 | 0.79 | KDM4E (0.58) | KDM4EHPGDMAPTTSHRALDH1A1 | |
| Salicylic Acid SCHEMBL2450905 | 0.78 | ALDH1A1 (0.78) | KDM4EHPGDMAPTTSHRALDH1A1 | |
| SCHEMBL10792918 | 0.78 | CYP19A1 (0.54) | KDM4EHPGDMAPTTSHRALDH1A1 | |
| SCHEMBL7826271 | 0.77 | KDM4E (0.56) | KDM4EHPGDMAPTTSHRALDH1A1 |
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-116829532-A | Substituted cyclohexane carboxamides, their preparation and their therapeutic use | 赛诺菲 | 2023-09-29 | — | — | CN | disclosed |