Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTN3A1 | O00481 | 4/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.49 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | CRHBP | P24387 | 1/20 | 0.47 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10149592 | 1.00 | BTN3A1 (0.50) | BTN3A1CA1CA2BCHEACHE | |
| SCHEMBL30089933 | 1.00 | BTN3A1 (0.50) | BTN3A1CA1CA2BCHEACHE | |
| SCHEMBL30583774 | 0.91 | ALDH1A1 (0.48) | BTN3A1CA1CA2BCHEACHE | |
| SCHEMBL14999631 | 0.91 | ALDH1A1 (0.47) | BTN3A1CA1CA2BCHEACHE | |
| SCHEMBL30511485 | 0.91 | CA1 (0.47) | BTN3A1CA1CA2BCHEACHE | |
| SCHEMBL28841769 | 0.91 | ALDH1A1 (0.47) | BTN3A1CA1CA2BCHEACHE | |
| SCHEMBL20059145 | 0.90 | ALDH1A1 (0.46) | BTN3A1CA1CA2BCHEACHE | |
| SCHEMBL15003930 | 0.90 | ALDH1A1 (0.46) | BTN3A1CA1CA2BCHEACHE | |
| SCHEMBL17403979 | 0.90 | ALDH1A1 (0.46) | BTN3A1CA1CA2BCHEACHE | |
| SCHEMBL13469579 | 0.90 | ALDH1A1 (0.47) | BTN3A1CA1CA2BCHEACHE |
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-115175735-A | Antiviral compounds | 吉利德科学公司 | 2022-10-11 | — | — | CN | disclosed |