Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FBP1 | P09467 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP12 | P39900 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | DAO | P14920 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL251357 | 0.81 | MGMT (0.40) | FBP1TAAR1MMP1MMP2MMP9 | |
| SCHEMBL9682640 | 0.79 | MGMT (0.39) | FBP1TAAR1MMP1MMP2MMP9 | |
| Hydroquinone SCHEMBL11860321 | 0.78 | L3MBTL1 (0.39) | MMP1MMP2MMP9MMP12CES2 | |
| SCHEMBL700807 | 0.78 | — | — | |
| SCHEMBL2404075 | 0.77 | — | — | |
| SCHEMBL16553362 | 0.77 | — | — | |
| SCHEMBL181927 | 0.77 | — | — | |
| SCHEMBL247102 | 0.77 | — | — | |
| SCHEMBL266567 | 0.77 | — | — | |
| SCHEMBL73652 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110168367-A | Biological thiol detection combination object comprising redox regulatory protein | 汉阳大学校产学协力团 | 2019-08-23 | — | — | CN | disclosed |
| WO-2009134227-A1 | POL YARYLENE POLYMERS RESULTING FROM DIELS-ALDER REACTION | ENERGY MATERIALS CORPORATION (US) | 2009-11-05 | — | — | WO | disclosed |
| US-20090264544-A1 | Polyarylene polymers and ion conducting functionalized polyarylene polymers resulting from pairing bis-diene arylenes and bis-dienophile arylenes via a diels-alder reaction | ENERGY MATERIALS CORPORATION | 2009-10-22 | — | — | US | disclosed |