Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.71 |
| ▸ | ACE | P12821 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.48 |
| ▸ | MME | P08473 | 1/20 | 0.46 |
| ▸ | CPA1 | P15085 | 1/20 | 0.46 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.46 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.45 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL107180 | 0.88 | TRPA1 (0.67) | TRPA1ACECYP2D6TAAR1SIGMAR1 | |
| SCHEMBL12768230 | 0.83 | TRPA1 (1.00) | TRPA1ACECYP2D6TAAR1SIGMAR1 | |
| SCHEMBL18456337 | 0.83 | TRPA1 (1.00) | TRPA1ACECYP2D6TAAR1SIGMAR1 | |
| SCHEMBL27488468 | 0.83 | TRPA1 (0.70) | TRPA1CYP2D6TAAR1SIGMAR1SLC6A2 | |
| SCHEMBL105517 | 0.83 | TRPA1 (0.70) | TRPA1CYP2D6TAAR1SIGMAR1SLC6A2 | |
| SCHEMBL5564289 | 0.82 | TRPA1 (0.59) | TRPA1ACECYP2D6TAAR1SIGMAR1 | |
| SCHEMBL8528186 | 0.82 | TRPA1 (0.58) | TRPA1CYP2D6TAAR1SIGMAR1SLC6A2 | |
| SCHEMBL107335 | 0.80 | TRPA1 (0.61) | TRPA1CYP2D6TAAR1SIGMAR1SLC6A2 | |
| SCHEMBL873142 | 0.80 | TRPA1 (0.61) | TRPA1CYP2D6TAAR1SIGMAR1SLC6A2 | |
| SCHEMBL1406203 | 0.80 | TRPA1 (0.67) | TRPA1ACECYP2D6TAAR1SIGMAR1 |
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-0656887-A1 | HYDROXYETHYLAMINO SULFONAMIDES USEFUL AS RETROVIRAL PROTEASE INHIBITORS | G.D. SEARLE & CO. (US) | 1995-06-14 | — | — | EP | claimed |
| CN-114874121-A | Method for preparing material containing monothiocarbonate group and product | 浙江大学 | 2022-08-09 | — | — | CN | disclosed |
| CN-103154082-B | Polycarbonate resin and molded article | TEIJIN CHEMICALS LTD | 2015-03-18 | — | — | CN | disclosed |
| CN-103154082-A | Polycarbonate resin and molded article | TEIJIN CHEMICALS LTD | 2013-06-12 | — | — | CN | disclosed |
| US-5786483-A | α-and β-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors | G. D. SEARLE & CO. (US) | 1998-07-28 | — | — | US | disclosed |