Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 8/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9783434 | 0.81 | TAAR1 (0.41) | TAAR1HRH3CYP19A1HRH4 | |
| SCHEMBL9783409 | 0.78 | TAAR1 (0.45) | TAAR1HRH3CYP19A1ADRA1DADRA1A | |
| SCHEMBL9783013 | 0.77 | CYP17A1 (0.41) | TAAR1CYP19A1HRH4 | |
| SCHEMBL9783329 | 0.77 | CYP19A1 (0.48) | TAAR1HRH3CYP19A1HRH4 | |
| SCHEMBL9783641 | 0.76 | TAAR1 (0.46) | TAAR1HRH3CYP19A1ADRA1DADRA1A | |
| SCHEMBL9783723 | 0.74 | HRH3 (0.49) | TAAR1HRH3CYP19A1HRH4 | |
| SCHEMBL233717 | 0.74 | — | — | |
| SCHEMBL9783961 | 0.70 | TAAR1 (0.43) | TAAR1HRH3CYP19A1ADRA1DADRA1A | |
| SCHEMBL9783426 | 0.70 | TAAR1 (0.45) | TAAR1HRH3CYP19A1ADRA1DADRA1A | |
| SCHEMBL9783648 | 0.68 | TAAR1 (0.43) | TAAR1HRH3CYP19A1ADRA1DADRA1A |
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 |