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 | |
|---|---|---|---|---|
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.56 |
| ▸ | ADRB1 known ✓ | P08588 | 1/20 | 0.56 |
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.48 |
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.48 |
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.48 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.48 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.48 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.48 |
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.48 |
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.48 |
| ▸ | ADRA1D known ✓ | P25100 | 1/20 | 0.48 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.48 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.48 |
| ▸ | ADRA1B known ✓ | P35368 | 1/20 | 0.48 |
| ▸ | HTR3A known ✓ | P46098 | 1/20 | 0.48 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.48 |
| ▸ | HTR7 | P34969 | 3/20 | 0.66 |
| ▸ | SLC6A9 | P48067 | 4/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
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 SCHEMBL11620502 | 0.90 | HTR7 (0.56) | HTR7SLC6A9KDM4EALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11621204 | 0.88 | KDM4E (0.59) | HTR7SLC6A9KDM4EALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11621689 | 0.88 | KDM4E (0.59) | HTR7SLC6A9KDM4EALDH1A1SMN1; SMN2 | |
| Bromide SCHEMBL11619657 | 0.81 | PTGDR2 (0.51) | HTR7SLC6A9KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL7956976 | 0.81 | SMN1; SMN2 (0.54) | HTR7SLC6A9KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL11619688 | 0.80 | PTGDR2 (0.63) | HTR7SLC6A9PTGDR2MAPK1 | |
| Hydrochloric Acid SCHEMBL11620740 | 0.80 | SLC6A9 (0.57) | HTR7SLC6A9KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL29904797 | 0.80 | HTR7 (1.00) | HTR7KDM4EALDH1A1SMN1; SMN2ADRB2 | |
| SCHEMBL11617344 | 0.80 | PTGDR2 (0.52) | HTR7SLC6A9KDM4EALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11621594 | 0.80 | PTGDR2 (0.52) | HTR7SLC6A9KDM4EALDH1A1PTGDR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4074998-A | USING A SUBSTITUTED PHENOXYALKYLAMINE OR PHENYLTHIOALKYLAMINE | ELI LILLY AND COMPANY (US) | 1978-02-21 | — | — | US | disclosed |