Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | TRPM8 | Q7Z2W7 | 4/20 | 0.44 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| Butane SCHEMBL8089205 | 0.94 | TAAR1 (0.52) | TAAR1PTGS1PTGS2ADRA2AADRA2B | |
| Ethane SCHEMBL8092722 | 0.93 | TAAR1 (0.56) | TAAR1PTGS1PTGS2ADRA2AADRA2B | |
| SCHEMBL150608 | 0.93 | — | — | |
| SCHEMBL28482425 | 0.91 | — | — | |
| SCHEMBL27822978 | 0.91 | — | — | |
| Methane SCHEMBL8089297 | 0.91 | — | — | |
| Pentane SCHEMBL8094684 | 0.90 | TAAR1 (0.53) | TAAR1PTGS1PTGS2ADRA2AADRA2B | |
| Hydrochloric Acid SCHEMBL28485453 | 0.89 | TAAR1 (0.56) | TAAR1PTGS1PTGS2ADRA2AADRA2B | |
| Magnesium Chloride Anhydrous SCHEMBL28485452 | 0.85 | TAAR1 (0.52) | TAAR1PTGS1PTGS2ADRA2AADRA2B | |
| SCHEMBL28068496 | 0.84 | TAAR1 (0.50) | TAAR1PTGS1PTGS2ADRA2AADRA2B |
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-6043368-A | Method of making thieno-pyridine derivatives | POLI INDUSTRIA CHIMICA, S.P.A. (IT) | 2000-03-28 | — | — | US | disclosed |
| EP-0829482-A2 | Method of making thieno-pyridine derivatives | Poli Industria Chimica S.p.A. (IT) | 1998-03-18 | — | — | EP | disclosed |