Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.55 |
| ▸ | NSD2 | O96028 | 2/20 | 0.55 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.55 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.50 |
| ▸ | S100A4 | P26447 | 3/20 | 0.46 |
| ▸ | TGM2 | P21980 | 1/20 | 0.46 |
| ▸ | PADI1 | Q9ULC6 | 1/20 | 0.46 |
| ▸ | PADI3 | Q9ULW8 | 1/20 | 0.46 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.46 |
| ▸ | PADI2 | Q9Y2J8 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | CDC25B | P30305 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | USP2 | O75604 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | CDC25A | P30304 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29429719 | 0.88 | PTPN1 (0.68) | PTPN1NSD2HKDC1SLC2A1S100A4 | |
| SCHEMBL228360 | 0.88 | PTPN1 (0.68) | PTPN1NSD2HKDC1SLC2A1S100A4 | |
| Sulfuric Acid SCHEMBL10338517 | 0.81 | HKDC1 (0.59) | PTPN1NSD2HKDC1SLC2A1S100A4 | |
| 4-Amino-[1,2]Naphthoquinone SCHEMBL422308 | 0.71 | PTPN1 (1.00) | PTPN1NSD2HKDC1SLC2A1S100A4 | |
| 4-Amino-[1,2]Naphthoquinone SCHEMBL5051876 | 0.70 | PTPN1 (0.95) | PTPN1NSD2HKDC1SLC2A1S100A4 | |
| 4-Amino-[1,2]Naphthoquinone SCHEMBL5161711 | 0.70 | PTPN1 (0.95) | PTPN1NSD2HKDC1SLC2A1S100A4 | |
| SCHEMBL31744557 | 0.69 | GAPDH (0.49) | PTPN1NSD2HKDC1SLC2A1S100A4 | |
| SCHEMBL3273421 | 0.68 | SLC2A1 (0.96) | PTPN1NSD2HKDC1SLC2A1S100A4 | |
| SCHEMBL11878878 | 0.68 | NSD2 (0.52) | PTPN1NSD2HKDC1SLC2A1S100A4 | |
| SCHEMBL7365674 | 0.67 | MEN1 (0.65) | PTPN1NSD2HKDC1SLC2A1S100A4 |
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-111606843-A | Synthetic method of 2-phenylseleno-3-amino-1, 4-naphthoquinone | 温州医科大学 | 2020-09-01 | — | — | CN | disclosed |