Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | KCNA5 | P22460 | 3/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.31 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.31 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | FNTA | P49354 | 2/20 | 0.31 |
| ▸ | FNTB | P49356 | 2/20 | 0.31 |
| ▸ | AKT2 | P31751 | 1/20 | 0.30 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.30 |
| ▸ | HCRTR2 | O43614 | 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 | |
|---|---|---|---|---|
| SCHEMBL9247260 | 0.91 | ADRA2A (0.44) | ADRA2AADRA2BADRA2CADRA1AHTR1A | |
| SCHEMBL9249050 | 0.84 | KCNA5 (0.39) | KCNA5SCN5AMAOBIP6K1ADAM17 | |
| SCHEMBL9250617 | 0.82 | KCNA5 (0.43) | KCNA5SCN5AMAOBADAM17SLC18A2 | |
| SCHEMBL9246193 | 0.82 | ADRA2A (0.44) | ADRA2AADRA2BADRA2CKCNA5SCN5A | |
| SCHEMBL9244403 | 0.78 | POLB (0.45) | KCNA5SCN5ASLC18A2FNTAFNTB | |
| SCHEMBL9249281 | 0.76 | KCNA5 (0.39) | KCNA5SCN5ASLC18A2 | |
| SCHEMBL9244512 | 0.74 | CNR2 (0.37) | HCRTR1HCRTR2 | |
| SCHEMBL9244535 | 0.72 | ADRA2A (0.46) | ADRA2AADRA2BADRA2CADRA1AHTR1A | |
| SCHEMBL9244528 | 0.72 | ADRA2A (0.46) | ADRA2AADRA2BADRA2CADRA1AHTR1A | |
| SCHEMBL9241754 | 0.72 | EPHX1 (0.36) | HCRTR1HCRTR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5449785-A | Fungicides with triazole groups | HOFFMANN-LA ROCHE INC. (US) | 1995-09-12 | — | — | US | disclosed |
| EP-0524439-A1 | Novel cyclohexane and tetrahydropyran derivatives and antifungal compositions containing these derivatives | F.HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) | 1993-01-27 | — | — | EP | disclosed |