Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.34 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL9435890 | 0.87 | CYP3A4 (0.48) | CYP3A4TSHRMAPTCACNA1BAPBA1 | |
| SCHEMBL47912 | 0.85 | CYP3A4 (0.45) | CYP3A4TSHRMAPTCACNA1BAPBA1 | |
| SCHEMBL9110969 | 0.83 | CYP3A4 (0.43) | CYP3A4TSHRMAPTCACNA1BAPBA1 | |
| Ethylene Glycol SCHEMBL1923456 | 0.79 | CYP3A4 (0.41) | CYP3A4TSHRMAPTCACNA1BAPBA1 | |
| Vinyl Ether SCHEMBL9746679 | 0.77 | CYP3A4 (0.39) | CYP3A4TSHRMAPTCACNA1BAPBA1 | |
| SCHEMBL2659946 | 0.77 | CYP3A4 (0.44) | CYP3A4TSHRMAPTCACNA1BAPBA1 | |
| SCHEMBL7094613 | 0.75 | MAPT (0.44) | CYP3A4TSHRMAPTCACNA1BAPBA1 | |
| 1,3-Propanediol SCHEMBL28898064 | 0.75 | TSHR (0.40) | CYP3A4TSHRMAPTCACNA1BAPBA1 | |
| SCHEMBL7096132 | 0.75 | SOAT1 (0.65) | CYP3A4TSHRMAPTCACNA1BAPBA1 | |
| 1,4-Butanediol SCHEMBL28454894 | 0.75 | TSHR (0.40) | CYP3A4TSHRMAPTCACNA1BAPBA1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8673885-B1 | Compounds for the protection of sulfur containing linkers in nucleic acid synthesis | DUFF ROBERT (US) | 2014-03-18 | — | — | US | disclosed |