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 | |
|---|---|---|---|---|
| SCHEMBL865898 | 0.82 | — | — | |
| Bromide SCHEMBL11421489 | 0.82 | — | — | |
| SCHEMBL4633106 | 0.82 | — | — | |
| Bromide SCHEMBL1997111 | 0.82 | — | — | |
| Bromide SCHEMBL11426924 | 0.82 | — | — | |
| Bromide SCHEMBL8628204 | 0.82 | — | — | |
| Bromide SCHEMBL35497 | 0.82 | — | — | |
| Bromide SCHEMBL3930426 | 0.82 | — | — | |
| Bromide SCHEMBL17961708 | 0.82 | — | — | |
| Bromide SCHEMBL8031212 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0306969-B1 | A process for producing an alpha-acyloxy-alpha beta-unsaturated carbonyl compound and a 20-acyl-oxy-17(20)-methylen-21-al-steroid compound | NIPPON ZEON CO (JP) | 1994-11-30 | — | — | EP | disclosed |
| US-5169966-A | Oxidizing in presence of platinum compound or complexes catalyst; chemical intermediates | NIPPON ZEON CO., LTD (JP) | 1992-12-08 | — | — | US | disclosed |
| US-5084584-A | Oxidation of a propargyl compound | NIPPON ZEON CO., LTD. (JP) | 1992-01-28 | — | — | US | disclosed |
| EP-0306969-A2 | A process for producing an alpha-acyloxy-alpha beta-unsaturated carbonyl compound and a 20-acyl-oxy-17(20)-methylen-21-al-steroid compound | NIPPON ZEON CO., LTD. (JP) | 1989-03-15 | — | — | EP | disclosed |