Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ANPEP | P15144 | 1/20 | 0.40 |
| ▸ | ADH1B | P00325 | 1/20 | 0.32 |
| ▸ | ADH1A | P07327 | 1/20 | 0.32 |
| ▸ | ADH7 | P40394 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14536466 | 0.90 | ALDH1A1 (0.56) | ALDH1A1CYP3A4TSHRANPEP | |
| SCHEMBL5932399 | 0.85 | ALDH1A1 (0.55) | ALDH1A1CYP3A4TSHR | |
| SCHEMBL25934706 | 0.80 | TSHR (0.52) | ALDH1A1CYP3A4TSHRANPEPADH1B | |
| SCHEMBL118857 | 0.80 | TSHR (0.52) | ALDH1A1CYP3A4TSHRANPEPADH1B | |
| SCHEMBL115493 | 0.80 | TSHR (0.52) | ALDH1A1CYP3A4TSHRANPEPADH1B | |
| SCHEMBL25007404 | 0.80 | TSHR (0.37) | ALDH1A1CYP3A4TSHR | |
| SCHEMBL21705186 | 0.80 | TSHR (0.44) | ALDH1A1CYP3A4TSHR | |
| SCHEMBL3633660 | 0.80 | ALDH1A1 (0.50) | ALDH1A1CYP3A4TSHRANPEPADH1B | |
| SCHEMBL25933010 | 0.79 | ALDH1A1 (0.50) | ALDH1A1CYP3A4TSHRANPEPADH1B | |
| SCHEMBL21907251 | 0.78 | ALDH1A1 (0.35) | ALDH1A1CYP3A4TSHRANPEPADH1B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019173539-A1 | NITRIC OXIDE-RELEASING CYCLODEXTRINS AS BIODEGRADABLE ANTIBACTERIAL SCAFFOLDS AND METHODS PERTAINING THERETO | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2019-09-12 | — | — | WO | disclosed |
| EP-2699546-B1 | GAS CAPTURE PROCESS | COMMONWEALTH SCIENT & INDUSTRIAL RESEARCH ORGANISATION (AU) | 2019-06-26 | — | — | EP | disclosed |