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 | |
|---|---|---|---|---|
| ▸ | SLC6A4 known ✓ | P31645 | 5/20 | 0.53 |
| ▸ | SLC6A2 known ✓ | P23975 | 3/20 | 0.53 |
| ▸ | SLC6A3 known ✓ | Q01959 | 2/20 | 0.46 |
| ▸ | HTR1D known ✓ | P28221 | 1/20 | 0.42 |
| ▸ | HTR1B known ✓ | P28222 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 2/20 | 0.49 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.45 |
| ▸ | LSS | P48449 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9185533 | 0.98 | SLC6A4 (0.54) | SLC6A4SLC6A2LTA4HSLC6A3KCNA3 | |
| SCHEMBL9180605 | 0.90 | SLC6A2 (0.53) | SLC6A4SLC6A2LTA4HSLC6A3KCNA3 | |
| Hydrochloric Acid SCHEMBL9179819 | 0.88 | SLC6A2 (0.51) | SLC6A4SLC6A2LTA4HSLC6A3KCNA3 | |
| SCHEMBL9183113 | 0.81 | LTA4H (0.46) | LTA4HKCNA3 | |
| SCHEMBL9539239 | 0.79 | KCNA3 (0.45) | LTA4HKCNA3HDAC3HDAC4HDAC1 | |
| SCHEMBL9182367 | 0.75 | LTA4H (0.50) | SLC6A4SLC6A2LTA4HSLC6A3HTR2A | |
| SCHEMBL9179867 | 0.75 | SLC6A4 (0.45) | SLC6A4SLC6A2SLC6A3HTR2ATAAR1 | |
| SCHEMBL9187372 | 0.74 | KDM4E (0.50) | SLC6A4SLC6A2LTA4HKCNA3HTR1B | |
| SCHEMBL125255 | 0.74 | ALDH1A1 (0.57) | SLC6A4SLC6A2SLC6A3HTR2ATAAR1 | |
| SCHEMBL29729780 | 0.74 | ALDH1A1 (0.57) | SLC6A4SLC6A2SLC6A3HTR2ATAAR1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0549773-B1 | ETHER-CONTAINING QUATERNARY AMMONIUM SALTS | EASTMAN KODAK CO (US) | 1995-07-05 | — | — | EP | claimed |
| EP-0549773-A1 | ETHER-CONTAINING QUATERNARY AMMONIUM SALTS. | EASTMAN KODAK CO (US) | 1993-07-07 | — | — | EP | claimed |
| WO-1993002040-A1 | ETHER-CONTAINING QUATERNARY AMMONIUM SALTS | EASTMAN KODAK COMPANY (US) | 1993-02-04 | — | — | WO | claimed |
| US-5126225-A | Lower fusion temperatures, improved adhesion to paper | EASTMAN KODAK COMPANY (US) | 1992-06-30 | — | — | US | claimed |
| EP-0549773-B1 | ETHER-CONTAINING QUATERNARY AMMONIUM SALTS | EASTMAN KODAK CO (US) | 1995-07-05 | — | — | EP | disclosed |
| EP-0549773-A1 | ETHER-CONTAINING QUATERNARY AMMONIUM SALTS. | EASTMAN KODAK CO (US) | 1993-07-07 | — | — | EP | disclosed |
| WO-1993002040-A1 | ETHER-CONTAINING QUATERNARY AMMONIUM SALTS | EASTMAN KODAK COMPANY (US) | 1993-02-04 | — | — | WO | disclosed |
| US-5126225-A | Lower fusion temperatures, improved adhesion to paper | EASTMAN KODAK COMPANY (US) | 1992-06-30 | — | — | US | disclosed |