Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3987895 | 0.79 | TAAR1 (0.35) | ALDH1A1 | |
| SCHEMBL9672993 | 0.76 | TSHR (0.36) | TRPA1ALDH1A1TSHR | |
| SCHEMBL11736293 | 0.71 | SMN1; SMN2 (0.40) | — | |
| SCHEMBL11740144 | 0.70 | NOS3 (0.36) | ALDH1A1 | |
| SCHEMBL11046196 | 0.69 | TSHR (0.46) | TRPA1ALDH1A1TSHR | |
| SCHEMBL11863652 | 0.69 | LTA4H (0.41) | ALDH1A1TSHR | |
| SCHEMBL11869338 | 0.69 | LTA4H (0.41) | ALDH1A1 | |
| SCHEMBL11860662 | 0.69 | MAOA (0.40) | ALDH1A1 | |
| SCHEMBL11875611 | 0.69 | TEAD4 (0.40) | ALDH1A1 | |
| SCHEMBL11041681 | 0.68 | MAOB (0.41) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993023373-A1 | N-[N'-(5-AMINO-4-HYDROXY-ACYLOYL)-α-AMINOACYLOYL] SUBSTITUTED HETEROCYCLES AND THEIR USE AS ANTIVIRAL AGENTS | PFIZER LIMITED (GB) | 1993-11-25 | — | — | WO | disclosed |