Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | TSHR | P16473 | 4/20 | 0.67 |
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.67 |
| ▸ | HPGD | P15428 | 2/20 | 0.67 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.67 |
| ▸ | TP53 | P04637 | 1/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.67 |
| ▸ | GAA | P10253 | 1/20 | 0.64 |
| ▸ | THRB | P10828 | 1/20 | 0.64 |
| ▸ | ERN1 | O75460 | 1/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.50 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| 4-Nitrocatechol SCHEMBL1608536 | 0.98 | TSHR (0.69) | ALDH1A1TSHRGPR35HPGDMAPK1 | |
| 4-Nitrocatechol SCHEMBL156909 | 0.98 | TSHR (0.69) | ALDH1A1TSHRGPR35HPGDMAPK1 | |
| 4-Nitrocatechol SCHEMBL11765698 | 0.98 | TSHR (0.69) | ALDH1A1TSHRGPR35HPGDMAPK1 | |
| 4-Nitrocatechol SCHEMBL4071135 | 0.95 | ALDH1A1 (0.67) | ALDH1A1TSHRGPR35HPGDMAPK1 | |
| 4-Nitrocatechol SCHEMBL2977452 | 0.90 | GPR35 (0.60) | ALDH1A1TSHRGPR35HPGDMAPK1 | |
| 4-Nitrocatechol SCHEMBL28778474 | 0.90 | ALDH1A1 (0.60) | ALDH1A1TSHRGPR35HPGDMAPK1 | |
| 4-Nitrocatechol SCHEMBL2977451 | 0.90 | GPR35 (0.60) | ALDH1A1TSHRGPR35HPGDMAPK1 | |
| 4-Nitrocatechol SCHEMBL30262908 | 0.88 | GPR35 (0.58) | ALDH1A1TSHRGPR35HPGDMAPK1 | |
| 4-Nitrocatechol SCHEMBL27738244 | 0.85 | GPR35 (0.55) | ALDH1A1TSHRGPR35HPGDMAPK1 | |
| SCHEMBL11028069 | 0.84 | GPR35 (0.69) | ALDH1A1TSHRGPR35HPGDMAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109585844-A | A kind of benefit sodium positive electrode active materials, positive electrode, sodium-ion battery and its preparation and application | 中南大学 | 2019-04-05 | — | — | CN | disclosed |