Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | HRH1 | P35367 | 2/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.41 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.41 |
| ▸ | PTAFR | P25105 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3920677 | 0.84 | TDP1 (0.53) | TDP1L3MBTL1CYP2A6HRH1CHRNA7 | |
| SCHEMBL14524266 | 0.82 | TDP1 (0.64) | TDP1L3MBTL1CYP2A6HRH1CHRNA7 | |
| SCHEMBL10045668 | 0.77 | TDP1 (0.49) | TDP1L3MBTL1CYP2A6HRH1CHRNA7 | |
| SCHEMBL10061567 | 0.77 | L3MBTL1 (0.75) | TDP1L3MBTL1CYP2A6HRH1CHRNA7 | |
| SCHEMBL23014817 | 0.77 | TDP1 (0.65) | TDP1L3MBTL1CYP2A6HRH1CHRNA7 | |
| SCHEMBL31686137 | 0.76 | CHRNB2 (0.49) | TDP1L3MBTL1CYP2A6CHRNA7CYP2D6 | |
| SCHEMBL26645944 | 0.76 | CHRNB2 (0.49) | TDP1L3MBTL1CYP2A6CHRNA7CYP2D6 | |
| SCHEMBL23015074 | 0.76 | TDP1 (0.68) | TDP1L3MBTL1CYP2A6HRH1CHRNA7 | |
| SCHEMBL2608878 | 0.76 | TDP1 (0.54) | TDP1L3MBTL1CYP2A6HRH1CHRNA7 | |
| SCHEMBL2088563 | 0.75 | CYP2A6 (0.54) | TDP1L3MBTL1CYP2A6HRH1CHRNA7 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0288279-B1 | 1,3-DIOXANES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-09-09 | — | — | EP | disclosed |
| CN-1015893-B | 1,3-DIOXANES | ICI LTD (GB) | 1992-03-18 | — | — | CN | disclosed |
| US-4921866-A | 1,3-dioxanes | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-05-01 | — | — | US | disclosed |
| CN-88102356-A | 1,3-two alkanes | — | 1988-12-28 | — | — | CN | disclosed |
| EP-0288279-A2 | 1,3-Dioxanes | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-10-26 | — | — | EP | disclosed |