Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9783769 | 0.79 | PCSK9 (0.40) | TAAR1IDO1CYP19A1CYP17A1CYP3A4 | |
| SCHEMBL9783302 | 0.74 | CYP17A1 (0.33) | TAAR1IDO1CYP17A1CYP3A4 | |
| SCHEMBL9783499 | 0.67 | RAF1 (0.30) | — | |
| SCHEMBL18202358 | 0.66 | LIPG (0.45) | — | |
| SCHEMBL9783334 | 0.63 | IDO1 (0.61) | IDO1CYP19A1CYP3A4 | |
| SCHEMBL9783723 | 0.62 | HRH3 (0.49) | TAAR1CYP19A1 | |
| SCHEMBL9783623 | 0.62 | CYP3A4 (0.36) | TAAR1IDO1CYP19A1CYP17A1CYP3A4 | |
| SCHEMBL9783497 | 0.61 | HSP90AA1 (0.34) | — | |
| SCHEMBL9783836 | 0.61 | CYP3A4 (0.39) | TAAR1IDO1CYP19A1CYP17A1CYP3A4 | |
| SCHEMBL9783702 | 0.60 | CYP19A1 (0.55) | TAAR1CYP19A1CYP17A1CYP3A4 |
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 |