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 | |
|---|---|---|---|---|
| SCHEMBL28776 | 0.98 | — | — | |
| SCHEMBL2014183 | 0.98 | CYP11B2 (0.61) | — | |
| SCHEMBL29434996 | 0.98 | — | — | |
| Water SCHEMBL28116587 | 0.98 | — | — | |
| Water SCHEMBL4803706 | 0.98 | CYP11B2 (0.61) | — | |
| Benzene SCHEMBL15416232 | 0.95 | CYP11B2 (0.59) | — | |
| Hydrochloric Acid SCHEMBL22031517 | 0.95 | CYP11B2 (0.59) | — | |
| Hydrochloric Acid SCHEMBL29882448 | 0.95 | CYP11B2 (0.59) | — | |
| Hydrochloric Acid SCHEMBL6439131 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL32685327 | 0.95 | CYP11B2 (0.59) | — |
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-2465849-A1 | 3-cyanopyridinium tricyanomethanides as ionic liquids | Lonza Ltd. (CH) | 2012-06-20 | — | — | EP | claimed |
| WO-2012076367-A1 | 3-CYANOPYRIDINIUM TRICYANOMETHANIDES | LONZA LTD (CH) | 2012-06-14 | — | — | WO | claimed |
| EP-2465849-A1 | 3-cyanopyridinium tricyanomethanides as ionic liquids | Lonza Ltd. (CH) | 2012-06-20 | — | — | EP | disclosed |
| WO-2012076367-A1 | 3-CYANOPYRIDINIUM TRICYANOMETHANIDES | LONZA LTD (CH) | 2012-06-14 | — | — | WO | disclosed |