Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 4/20 | 0.42 |
| ▸ | PTPN6 | P29350 | 2/20 | 0.42 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | HNF4A | P41235 | 1/20 | 0.37 |
| ▸ | IAPP | P10997 | 2/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9551140 | 0.85 | AKR1C3 (0.45) | PTPN1PTPN6PTPN2AKR1C3AKR1C2 | |
| SCHEMBL9813051 | 0.85 | PTPN1 (0.44) | PTPN1PTPN6PTPN2AKR1C3AKR1C2 | |
| SCHEMBL9550710 | 0.85 | ALDH1A1 (0.49) | PTPN1PTPN6PTPN2AKR1C3AKR1C2 | |
| SCHEMBL9550715 | 0.82 | PTPN1 (0.41) | PTPN1PTPN6PTPN2AKR1C3AKR1C2 | |
| SCHEMBL9550720 | 0.82 | BACE1 (0.42) | PTPN1PTPN6PTPN2AKR1C3AKR1C2 | |
| SCHEMBL9551123 | 0.81 | PTPN1 (0.36) | PTPN1PTPN6PTPN2AKR1C3AKR1C2 | |
| SCHEMBL9550711 | 0.80 | ALDH1A1 (0.47) | PTPN1PTPN6PTPN2AKR1C3AKR1C2 | |
| SCHEMBL9813187 | 0.80 | AKR1C3 (0.43) | PTPN1PTPN6PTPN2AKR1C3AKR1C2 | |
| SCHEMBL199038 | 0.79 | ALDH1A1 (0.43) | PTPN1PTPN6PTPN2AKR1C3AKR1C2 | |
| SCHEMBL9838242 | 0.77 | TDP1 (0.44) | CYP1A2CYP3A4CYP2D6CYP2C19ALDH1A1 |
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-5229421-A | Antiallergens, antiinflammatory agents | G. D. SEARLE & CO. (US) | 1993-07-20 | — | — | US | disclosed |
| EP-0339688-B1 | HYDROXYPHENYLTHIOALKYLKETONES | G.D. Searle & Co. (US) | 1993-03-10 | — | — | EP | disclosed |
| US-4857558-A | ANTIINFLAMMATORY AGENTS AND-OR ANTIALLERGENS | G. D. SEARLE & CO. (US) | 1989-08-15 | — | — | US | disclosed |