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 | 0.43 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.43 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.43 |
| ▸ | CFTR | P13569 | 1/20 | 0.43 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.39 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27626895 | 0.98 | SMN1; SMN2 (0.47) | SMN1; SMN2LMNAL3MBTL1TBXAS1CFTR | |
| SCHEMBL28803513 | 0.81 | SMN1; SMN2 (0.47) | SMN1; SMN2LMNAL3MBTL1TBXAS1CFTR | |
| Hydrochloric Acid SCHEMBL27645555 | 0.79 | SMN1; SMN2 (0.46) | SMN1; SMN2LMNAL3MBTL1TBXAS1CFTR | |
| Bromide SCHEMBL27614962 | 0.78 | LMNA (0.41) | SMN1; SMN2LMNAL3MBTL1SLC6A2SLC6A4 | |
| Bromide SCHEMBL10568551 | 0.78 | SMN1; SMN2 (0.55) | SMN1; SMN2LMNAL3MBTL1CFTRSLC6A2 | |
| SCHEMBL235125 | 0.76 | SMN1; SMN2 (0.50) | SMN1; SMN2LMNAL3MBTL1TBXAS1CFTR | |
| SCHEMBL29852444 | 0.76 | SMN1; SMN2 (0.50) | SMN1; SMN2LMNAL3MBTL1TBXAS1CFTR | |
| SCHEMBL6075149 | 0.76 | SMN1; SMN2 (0.57) | SMN1; SMN2LMNAL3MBTL1CFTRSLC6A2 | |
| SCHEMBL6307776 | 0.76 | SMN1; SMN2 (0.57) | SMN1; SMN2LMNAL3MBTL1CFTRSLC6A2 | |
| SCHEMBL4476838 | 0.76 | SMN1; SMN2 (0.57) | SMN1; SMN2LMNAL3MBTL1CFTRSLC6A2 |
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-103281901-B | Pesticidal compositions and methods related thereto | 陶氏益农公司 | 2016-12-28 | — | — | CN | disclosed |
| CN-104039791-B | [1, 2, 3] triazolo [4, 5-D ] pyrimidine derivatives as cannabinoid receptor 2 agonists | 霍夫曼-拉罗奇有限公司 | 2016-11-09 | — | — | CN | disclosed |
| CN-101006082-B | Histamine H3 receptor agents, methods of preparation and therapeutic uses | LILLY CO ELI | 2010-09-29 | — | — | CN | disclosed |
| CN-101006082-A | Histamine H3 receptor agents, methods of preparation and therapeutic uses | LILLY CO ELI (US) | 2007-07-25 | — | — | CN | disclosed |