Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL6800985 | 1.00 | — | — | |
| Bromide SCHEMBL5541 | 0.82 | — | — | |
| Potassium Ion SCHEMBL10653929 | 0.82 | — | — | |
| Potassium Ion SCHEMBL108499 | 0.82 | — | — | |
| Bromide SCHEMBL10505750 | 0.82 | — | — | |
| Bromide SCHEMBL187607 | 0.82 | CA4 (1.00) | — | |
| Bromide SCHEMBL186513 | 0.82 | — | — | |
| Potassium Ion SCHEMBL122678 | 0.82 | — | — | |
| Bromide SCHEMBL1524665 | 0.82 | — | — | |
| Potassium Ion SCHEMBL117587 | 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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108069946-B | Substituted quinazoline compounds having the ability to cross the blood brain barrier | 威尚（上海）生物医药有限公司 | 2020-06-05 | — | — | CN | disclosed |
| US-8071581-B2 | Triazolopyridazine protein kinase modulators | SGX PHARMACEUTICALS, INC. (US) | 2011-12-06 | — | — | US | disclosed |
| US-20100120739-A1 | TRIAZOLOPYRIDAZINE PROTEIN KINASE MODULATORS | SGX PHARMACEUTICALS, INC. | 2010-05-13 | — | — | US | disclosed |
| EP-2081937-A2 | TRIAZOLOPYRIDAZINE PROTEIN KINASE MODULATORS | SGX Pharmaceuticals, Inc. (US) | 2009-07-29 | — | — | EP | disclosed |
| WO-2008051805-A2 | TRIAZOLO-PYRIDAZINE PROTEIN KINASE MODULATORS | SGX PHARMACEUTICALS, INC. (US) | 2008-05-02 | — | — | WO | disclosed |
| US-20030171616-A1 | Process for producing acyl fluoride and carboxylic acid salt | ASAHI GLASS COMPANY LIMITED (JP) | 2003-09-11 | — | — | US | disclosed |
| EP-1323702-A1 | PROCESS FOR PRODUCING ACYL FLUORIDE AND CARBOXYLIC ACID SALT | ASAHI GLASS COMPANY LTD. (JP) | 2003-07-02 | — | — | EP | disclosed |
| US-6242391-B1 | BROMIDE ION, CARBONIC ACID AND HYDROGEN CARBONATE ION | YASIO FUKUTANI (JP) | 2001-06-05 | — | — | US | disclosed |
| EP-1013751-A1 | WATER-SOLUBLE CUTTING FLUID | Fukutani, Yasuo (JP) | 2000-06-28 | — | — | EP | disclosed |