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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.38 |
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 known ✓ | P08588 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.51 |
| ▸ | SLC6A9 | P48067 | 3/20 | 0.44 |
| ▸ | SCN4A | P35499 | 2/20 | 0.40 |
| ▸ | HTR7 | P34969 | 2/20 | 0.40 |
| ▸ | PTGER1 | P34995 | 4/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11619019 | 0.84 | PTGDR2 (0.56) | PTGDR2SLC6A9SCN4AHTR7HTR1A | |
| Bromide SCHEMBL11615212 | 0.79 | HTR7 (0.66) | PTGDR2SLC6A9HTR7HTR1AKDM4E | |
| Bromide SCHEMBL11619657 | 0.77 | PTGDR2 (0.51) | PTGDR2SLC6A9HTR7PTGER1KDM4E | |
| SCHEMBL11617344 | 0.75 | PTGDR2 (0.52) | PTGDR2SLC6A9HTR7PTGER1KDM4E | |
| SCHEMBL8220954 | 0.75 | HTR7 (0.46) | HTR7KDM4EALDH1A1ADRB2ADRB1 | |
| Hydrochloric Acid SCHEMBL11620502 | 0.75 | HTR7 (0.56) | PTGDR2SLC6A9HTR7KDM4EALDH1A1 | |
| SCHEMBL11646426 | 0.74 | PTGDR2 (0.54) | PTGDR2SLC6A9SCN4AHTR7HTR1A | |
| SCHEMBL8225836 | 0.74 | HTR7 (0.44) | HTR7KDM4EALDH1A1ADRB2ADRB1 | |
| Hydrochloric Acid SCHEMBL11621204 | 0.73 | KDM4E (0.59) | PTGDR2SLC6A9HTR7KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL11621689 | 0.73 | KDM4E (0.59) | PTGDR2SLC6A9HTR7KDM4EALDH1A1 |
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 |