Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2 | P10415 | 1/20 | 0.57 |
| ▸ | AGXT | P21549 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 2/20 | 0.40 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP12 | P39900 | 2/20 | 0.40 |
| ▸ | MME | P08473 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3037130 | 0.90 | BCL2 (0.67) | BCL2AGXTPTGS2TP53AOC3 | |
| Water SCHEMBL9719807 | 0.88 | BCL2 (0.65) | BCL2AGXTPTGS2TP53AOC3 | |
| SCHEMBL13447590 | 0.85 | AGXT (0.61) | BCL2AGXTAOC3HRH3NAAA | |
| SCHEMBL5547358 | 0.83 | BCL2 (0.62) | BCL2AGXTPTGS2TP53IDO1 | |
| SCHEMBL29489424 | 0.83 | BCL2 (0.62) | BCL2AGXTPTGS2TP53IDO1 | |
| Ether SCHEMBL9719783 | 0.82 | TP53 (0.54) | BCL2AGXTTP53IDO1CYP1A2 | |
| Ethylbenzene SCHEMBL4054027 | 0.81 | TP53 (0.74) | TP53IDO1CYP1A2CYP2A6 | |
| Biphenyl SCHEMBL5898513 | 0.81 | ALDH1A1 (0.53) | AGXTTP53IDO1 | |
| Biphenyl SCHEMBL8192900 | 0.81 | ALDH1A1 (0.53) | AGXTTP53IDO1 | |
| Biphenyl SCHEMBL1147617 | 0.81 | ALDH1A1 (0.53) | AGXTTP53IDO1 |
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-5078906-A | Organic lithium-potassium complexes for metallization reactions, preparation of aspirin substitutes, fenoprofen | MINE SAFETY APPLIANCES COMPANY (US) | 1992-01-07 | — | — | US | disclosed |
| EP-0379987-A2 | Process for the preparation of alpha-arylalkanoic acids | Mine Safety Appliances Company (US) | 1990-08-01 | — | — | EP | disclosed |
| US-4910337-A | Process for the preparation of α-arylalkanoic acids | MINE SAFETY APPLIANCES COMPANY (US) | 1990-03-20 | — | — | US | disclosed |