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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 known ✓ | P31645 | 4/20 | 0.50 |
| ▸ | HTR1A known ✓ | P08908 | 3/20 | 0.50 |
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.41 |
| ▸ | ADRA2C known ✓ | P18825 | 2/20 | 0.39 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.39 |
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | HRH2 | P25021 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9466633 | 0.80 | SLC6A4 (0.59) | SLC6A4HTR1AADRA2CHTR2BADRA2A | |
| Hydrochloric Acid SCHEMBL9523450 | 0.80 | HTR1A (0.70) | SLC6A4HTR1A | |
| Hydrochloric Acid SCHEMBL9521293 | 0.72 | HTR1A (0.63) | SLC6A4HTR1ATAAR1SIGMAR1 | |
| Bromide SCHEMBL9521059 | 0.71 | HTR1A (0.59) | SLC6A4HTR1ATAAR1SIGMAR1 | |
| Hydrochloric Acid SCHEMBL9521599 | 0.70 | HTR1A (0.69) | SLC6A4HTR1ATAAR1SIGMAR1 | |
| Bromide SCHEMBL9722858 | 0.69 | CARM1 (0.34) | SLC6A4TAAR1ADRA2CADRA2AADRA2B | |
| Hydrochloric Acid SCHEMBL9464551 | 0.68 | SLC6A4 (0.46) | SLC6A4HTR1AADRA2CHTR2BADRA2A | |
| Hydrochloric Acid SCHEMBL9523522 | 0.67 | HTR1A (0.69) | SLC6A4HTR1A | |
| SCHEMBL9531339 | 0.66 | HTR1A (0.57) | SLC6A4HTR1ATAAR1SIGMAR1 | |
| Hydrochloric Acid SCHEMBL9520941 | 0.65 | SLC6A4 (0.80) | SLC6A4HTR1AADRA2CADRA2AADRA2B |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5185364-A | Selectively inhibit alpha-2-adrenergic receptors | ABBOTT LABORATORIES (US) | 1993-02-09 | — | — | US | disclosed |
| US-5140039-A | Antidepressants, metabolic disorders | ABBOTT LABORATORIES (US) | 1992-08-18 | — | — | US | disclosed |
| US-5089519-A | Antidepressants; antagonists for alpha-2-adrenergic receptors | ABBOTT LABORATORIES (US) | 1992-02-18 | — | — | US | disclosed |
| EP-0396620-A4 | AMINOMETHYL-CHROMAN AND -THIOCHROMAN COMPOUNDS | — | 1991-01-23 | — | — | EP | disclosed |
| EP-0396620-A1 | AMINOMETHYL-CHROMAN AND -THIOCHROMAN COMPOUNDS. | ABBOTT LAB (US) | 1990-11-14 | — | — | EP | disclosed |
| EP-0325964-A1 | Aminomethyl-chroman and -thiochroman compounds | ABBOTT LABORATORIES (US) | 1989-08-02 | — | — | EP | disclosed |
| WO-1989006534-A1 | AMINOMETHYL-CHROMAN AND -THIOCHROMAN COMPOUNDS | ABBOTT LABORATORIES (US) | 1989-07-27 | — | — | WO | disclosed |