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 | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.52 |
| ▸ | CTSD | P07339 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL839250 | 0.97 | ALDH1A1 (0.55) | ALDH1A1TDP1CTSDMAPTCYP3A4 | |
| Hydrochloric Acid SCHEMBL2497266 | 0.95 | ALDH1A1 (0.52) | ALDH1A1TDP1CTSDMAPTCYP3A4 | |
| Oxalic Acid SCHEMBL28377528 | 0.87 | GAA (0.48) | ALDH1A1TDP1CTSDMAPTCYP3A4 | |
| Phosphoric Acid SCHEMBL28200165 | 0.85 | GAA (0.47) | ALDH1A1TDP1CTSDMAPTCYP3A4 | |
| Sulfuric Acid SCHEMBL28200156 | 0.85 | GAA (0.43) | ALDH1A1TDP1CTSDMAPTCYP3A4 | |
| SCHEMBL7408731 | 0.73 | PTGS2 (0.41) | ALDH1A1MAPTCYP3A4GAAALOX12 | |
| SCHEMBL5397882 | 0.72 | TDP1 (0.55) | ALDH1A1TDP1CTSDMAPTCYP3A4 | |
| SCHEMBL28221355 | 0.72 | KIF11 (0.49) | GAAHSD17B10TSHRALOX15L3MBTL1 | |
| Hydrochloric Acid SCHEMBL28200777 | 0.71 | KIF11 (0.47) | ALDH1A1TSHRPTGS1IDO1 | |
| SCHEMBL19737269 | 0.71 | ALDH1A1 (1.00) | ALDH1A1TDP1CTSDMAPTCYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107663161-B | Continuous flow synthesis process of phenylhydrazine salt and substituted phenylhydrazine salt | 上海惠和化德生物科技有限公司 | 2020-04-10 | — | — | CN | claimed |
| CN-107663161-B | Continuous flow synthesis process of phenylhydrazine salt and substituted phenylhydrazine salt | 上海惠和化德生物科技有限公司 | 2020-04-10 | — | — | CN | disclosed |