Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATP4A | P20648 | 2/20 | 0.32 |
| ▸ | ATP4B | P51164 | 2/20 | 0.32 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.30 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.30 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9783958 | 0.82 | PDE4A (0.35) | CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9783296 | 0.75 | CYP11B1 (0.38) | ATP4AATP4BHCAR1GABRG2GABRB3 | |
| SCHEMBL9783255 | 0.74 | CYP3A4 (0.32) | ATP4AATP4BHCAR1GABRG2GABRB3 | |
| SCHEMBL9783486 | 0.67 | PDE4A (0.37) | CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9784007 | 0.65 | PDE4A (0.36) | CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9783676 | 0.65 | HSD11B1 (0.34) | MAOAMAOBGABRG2GABRB3GABRA5 | |
| SCHEMBL9783961 | 0.63 | TAAR1 (0.43) | — | |
| SCHEMBL9783999 | 0.63 | — | — | |
| Imidazole SCHEMBL9783724 | 0.63 | ALDH1A1 (0.35) | — | |
| SCHEMBL11814050 | 0.63 | MAPK14 (0.41) | MAOAMAOB |
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 |