Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLN | Q9BYT8 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 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 | |
|---|---|---|---|---|
| Histidine SCHEMBL27702202 | 0.75 | CYP3A4 (0.78) | NLNCYP3A4SLC7A5 | |
| SCHEMBL18809892 | 0.71 | CYP3A4 (0.67) | NLNCYP3A4SLC7A5 | |
| Histidine SCHEMBL27676546 | 0.70 | CYP3A4 (0.78) | NLNCYP3A4SLC7A5 | |
| SCHEMBL6037588 | 0.69 | TRPM8 (0.40) | — | |
| SCHEMBL5702193 | 0.69 | CYP3A4 (0.55) | CYP3A4SLC7A5 | |
| SCHEMBL3632930 | 0.67 | CYP3A4 (0.60) | NLNCYP3A4SLC7A5 | |
| SCHEMBL18162806 | 0.67 | CYP3A4 (0.73) | CYP3A4SLC7A5 | |
| SCHEMBL13609239 | 0.67 | CYP3A4 (0.73) | CYP3A4SLC7A5 | |
| SCHEMBL7962292 | 0.67 | CYP3A4 (0.73) | CYP3A4SLC7A5 | |
| Histidine SCHEMBL27388700 | 0.66 | CYP3A4 (0.88) | NLNCYP3A4SLC7A5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0485458-A1 | THIOACYLATING REAGENTS AND INTERMEDIATES, THIOPEPTIDES, AND METHODS FOR PREPARING AND USING SAME. | IAF BIOCHEM INT (CA) | 1992-05-20 | — | — | EP | claimed |
| WO-1991001976-A1 | THIOACYLATING REAGENTS AND INTERMEDIATES, THIOPEPTIDES, AND METHODS FOR PREPARING AND USING SAME | IAF BIOCHEM INTERNATIONAL INC. (CA) | 1991-02-21 | — | — | WO | claimed |