Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 5/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL9783013 | 0.82 | CYP17A1 (0.41) | CYP17A1CYP3A4 | |
| SCHEMBL9783289 | 0.82 | MGLL (0.38) | MGLLCYP17A1CYP3A4HRH3 | |
| SCHEMBL9783584 | 0.76 | MGLL (0.42) | MGLLALDH1A1L3MBTL1 | |
| SCHEMBL9783307 | 0.73 | CYP17A1 (0.39) | CYP17A1CYP3A4HRH3ALDH1A1 | |
| SCHEMBL9783092 | 0.68 | MEN1 (0.44) | MGLLALDH1A1L3MBTL1 | |
| SCHEMBL9783373 | 0.68 | TAAR1 (0.50) | MGLLALDH1A1 | |
| SCHEMBL9843778 | 0.66 | QPCT (0.37) | MGLLALDH1A1 | |
| SCHEMBL9783836 | 0.65 | CYP3A4 (0.39) | CYP17A1CYP3A4HRH3 | |
| SCHEMBL9783377 | 0.65 | HRH3 (0.45) | MGLLHRH3 | |
| SCHEMBL9783410 | 0.65 | CTSK (0.35) | MGLLALDH1A1L3MBTL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5051514-A | Complexing boranes and imidazoles | CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) | 1991-09-24 | — | — | US | disclosed |
| EP-0432987-A2 | Fungicidal organoborane imidazole compounds and intermediates therefor | CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) | 1991-06-19 | — | — | EP | disclosed |
| US-4983589-A | Fungicidal imidazole diphenylaliphaticboranes and derivatives thereof | CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) | 1991-01-08 | — | — | US | disclosed |