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 | |
|---|---|---|---|---|
| SCHEMBL132482 | 0.95 | — | — | |
| Water SCHEMBL8211682 | 0.91 | — | — | |
| Iodide SCHEMBL5583242 | 0.91 | — | — | |
| SCHEMBL22228579 | 0.91 | CYP1A2 (0.40) | — | |
| Hydrochloric Acid SCHEMBL5143916 | 0.91 | — | — | |
| SCHEMBL18157901 | 0.91 | CYP1A2 (0.33) | — | |
| Iodide SCHEMBL29008420 | 0.91 | — | — | |
| SCHEMBL27723280 | 0.91 | — | — | |
| SCHEMBL18301490 | 0.81 | TDP1 (0.39) | — | |
| SCHEMBL22228557 | 0.81 | TDP1 (0.39) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9744392-B1 | Compounds and methods for the reduction of halogenated hydrocarbons | UNIVERSITY OF GUELPH (CA) | 2017-08-29 | — | — | US | disclosed |
| EP-0161550-B1 | PROCESS FOR PRODUCING AN ALIPHATIC ISOCYANATE | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1988-01-20 | — | — | EP | disclosed |
| US-4587056-A | CARBONYLATION, OXIDATION, CATALYST | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1986-05-06 | — | — | US | disclosed |
| EP-0161550-A1 | Process for producing an aliphatic isocyanate | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1985-11-21 | — | — | EP | disclosed |