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.
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 | |
|---|---|---|---|---|
| SCHEMBL4661861 | 0.96 | RAPGEF4 (0.30) | — | |
| Hydrochloric Acid SCHEMBL6547040 | 0.94 | — | — | |
| SCHEMBL17583797 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL28521740 | 0.74 | CYP1A2 (0.31) | — | |
| Hydrochloric Acid SCHEMBL28408398 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL28766395 | 0.73 | NOS3 (0.30) | — | |
| Hydrochloric Acid SCHEMBL27995882 | 0.70 | ALDH1A1 (0.33) | — | |
| Bromide SCHEMBL15271175 | 0.67 | — | — | |
| SCHEMBL28575906 | 0.66 | RAPGEF4 (0.35) | — | |
| SCHEMBL5157157 | 0.64 | RAPGEF4 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012112758-A2 | VIRTUAL HYDROGEN STORAGE PROCESSES AND RELATED CATALYSTS AND SYSTEMS | YALE UNIVERSITY (US) | 2012-08-23 | — | — | WO | disclosed |