Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.59 |
| ▸ | HRH1 | P35367 | 2/20 | 0.56 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.54 |
| ▸ | ANPEP | P15144 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.46 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.46 |
| ▸ | TBXAS1 | P24557 | 7/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.41 |
| ▸ | PTAFR | P25105 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6160644 | 0.81 | PTAFR (0.49) | CYP2A6HRH1PTAFR | |
| SCHEMBL6158950 | 0.80 | CYP2A6 (0.59) | CYP2A6HRH1CHRNA7TDP1L3MBTL1 | |
| SCHEMBL21361315 | 0.79 | CHRNA7 (0.55) | CYP2A6HRH1CHRNA7TDP1L3MBTL1 | |
| SCHEMBL6160319 | 0.77 | CYP2A6 (0.64) | CYP2A6HRH1CHRNA7TDP1L3MBTL1 | |
| SCHEMBL6161202 | 0.76 | HRH1 (0.59) | CYP2A6HRH1CHRNA7TDP1L3MBTL1 | |
| SCHEMBL1188053 | 0.76 | CYP2A6 (1.00) | CYP2A6HRH1CHRNA7TDP1L3MBTL1 | |
| SCHEMBL30393717 | 0.76 | CYP2A6 (1.00) | CYP2A6HRH1CHRNA7TDP1L3MBTL1 | |
| SCHEMBL6157740 | 0.75 | CYP2A6 (0.57) | CYP2A6HRH1CHRNA7TDP1L3MBTL1 | |
| SCHEMBL2564168 | 0.75 | CYP2A6 (0.56) | CYP2A6HRH1CHRNA7TDP1L3MBTL1 | |
| SCHEMBL9732269 | 0.75 | TBXAS1 (0.60) | CYP2A6HRH1TBXAS1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1129070-A4 | NEUROTROPHIC DIAMIDE AND CARBAMATE AGENTS | BRISTOL MYERS SQUIBB CO (US) | 2005-03-02 | — | — | EP | disclosed |
| EP-1129070-A1 | NEUROTROPHIC DIAMIDE AND CARBAMATE AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2001-09-05 | — | — | EP | disclosed |
| US-6228872-B1 | PEPTIDE-PROLYL ISOMERASE AND ROTAMASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY | 2001-05-08 | — | — | US | disclosed |
| WO-2000027811-A1 | NEUROTROPHIC DIAMIDE AND CARBAMATE AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2000-05-18 | — | — | WO | disclosed |