Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19861666 | 0.81 | CYP2D6 (0.37) | TRPV1 | |
| SCHEMBL19861605 | 0.79 | TRPV1 (0.41) | TRPV1ALDH1A1TSHR | |
| SCHEMBL2736125 | 0.75 | ALDH1A1 (0.35) | TRPV1ALDH1A1TSHR | |
| SCHEMBL13780653 | 0.75 | ACACB (0.37) | TRPV1ALDH1A1TSHR | |
| SCHEMBL14435659 | 0.72 | TRPV1 (0.44) | TRPV1ALDH1A1TSHR | |
| SCHEMBL18531963 | 0.72 | ALDH1A1 (0.33) | TRPV1ALDH1A1 | |
| SCHEMBL19861703 | 0.71 | TRPV1 (0.35) | TRPV1ALDH1A1 | |
| SCHEMBL19190505 | 0.70 | TAS1R3 (0.41) | ALDH1A1TSHR | |
| SCHEMBL20676375 | 0.69 | HTR2A (0.33) | ALDH1A1TSHR | |
| SCHEMBL21026079 | 0.69 | HTR2A (0.33) | ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-9891239-B2 | Modulators of pharmacokinetic properties of therapeutics | GILEAD SCIENCES, INC. (US) | 2018-02-13 | — | — | US | disclosed |