Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 2/20 | 0.63 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.56 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.56 |
| ▸ | HRH1 | P35367 | 2/20 | 0.55 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.50 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.50 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29485692 | 0.91 | CHRNA7 (0.74) | CHRNA7CYP2A6CYP1A2CYP2D6TDP1 | |
| SCHEMBL724866 | 0.91 | CHRNA7 (0.74) | CHRNA7CYP2A6CYP1A2CYP2D6TDP1 | |
| SCHEMBL13595083 | 0.90 | HRH1 (0.70) | CHRNA7CYP2A6TDP1L3MBTL1HRH4 | |
| SCHEMBL8700016 | 0.88 | CYP1A2 (0.66) | CHRNA7CYP2A6CYP1A2CYP2D6TDP1 | |
| SCHEMBL10452373 | 0.84 | CHRNA7 (0.65) | CHRNA7CYP2A6CYP1A2CYP2D6TDP1 | |
| SCHEMBL14536424 | 0.82 | — | — | |
| SCHEMBL29485675 | 0.81 | TDP1 (0.80) | CHRNA7CYP2A6CYP1A2CYP2D6TDP1 | |
| SCHEMBL29485677 | 0.81 | CYP2A6 (0.76) | CHRNA7CYP2A6CYP1A2CYP2D6TDP1 | |
| SCHEMBL2843094 | 0.81 | CYP2A6 (0.76) | CHRNA7CYP2A6CYP1A2CYP2D6TDP1 | |
| SCHEMBL724788 | 0.81 | TDP1 (0.80) | CHRNA7CYP2A6CYP1A2CYP2D6TDP1 |
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-6348477-B1 | SUBSTITUTED PHENYL THIAZOLE DERIVATIVES AS VIRICIDES | BOEHRINGER INGELHEIM(CANADA) LTD. (CA) | 2002-02-19 | — | — | US | claimed |
| CN-101268064-A | Pyrazine derivatives useful as adenosine receptor antagonists | ALMIRALL LAB (ES) | 2008-09-17 | — | — | CN | disclosed |
| US-6043227-A | C11 carbamates of macrolide antibacterials | PFIZER INC. (US) | 2000-03-28 | — | — | US | disclosed |