Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | TNKS | O95271 | 2/20 | 0.51 |
| ▸ | GABRP | O00591 | 3/20 | 0.50 |
| ▸ | GABRD | O14764 | 3/20 | 0.50 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.50 |
| ▸ | GABRB1 | P18505 | 3/20 | 0.50 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.50 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.50 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.50 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.50 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.50 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.50 |
| ▸ | GABRA4 | P48169 | 3/20 | 0.50 |
| ▸ | GABRE | P78334 | 3/20 | 0.50 |
| ▸ | GABRA6 | Q16445 | 3/20 | 0.50 |
| ▸ | GABRG1 | Q8N1C3 | 3/20 | 0.50 |
| ▸ | GABRG3 | Q99928 | 3/20 | 0.50 |
| ▸ | GABRQ | Q9UN88 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28384631 | 1.00 | ALDH1A1 (0.56) | ALDH1A1TSHRMAPK1TNKSGABRP | |
| SCHEMBL8366506 | 0.89 | PRKDC (0.51) | ALDH1A1TSHRMAPK1TNKSGABRP | |
| SCHEMBL28394479 | 0.85 | GABRP (0.55) | ALDH1A1TSHRMAPK1GABRPGABRD | |
| SCHEMBL28383699 | 0.83 | CYP1A2 (0.52) | ALDH1A1TNKSPRKDCPLA2G2APLA2G4A | |
| SCHEMBL6827690 | 0.83 | TNKS (0.51) | TNKSGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL28383892 | 0.83 | CYP1A2 (0.52) | ALDH1A1TNKSPRKDCPLA2G2APLA2G4A | |
| SCHEMBL6827288 | 0.83 | TNKS (0.51) | TNKSGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL6823834 | 0.82 | GABRP (0.51) | ALDH1A1TSHRMAPK1TNKSGABRP | |
| SCHEMBL7258141 | 0.79 | HPGD (0.55) | ALDH1A1TNKSGABRPGABRDGABRA1 | |
| SCHEMBL6824581 | 0.79 | EGFR (0.58) | ALDH1A1TNKSMAOBPRKDCNPC1 |
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-110922374-A | Method for synthesizing 2-pyrone compound by organic catalysis | 贵州大学 | 2020-03-27 | — | — | CN | disclosed |