Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9674059 | 0.84 | TSHR (0.31) | ALDH1A1 | |
| SCHEMBL6776792 | 0.81 | PTPN1 (0.35) | PTPN1 | |
| SCHEMBL2456321 | 0.80 | NQO1 (0.36) | ALDH1A1GLA | |
| SCHEMBL9723567 | 0.79 | L3MBTL1 (0.31) | — | |
| SCHEMBL28843377 | 0.79 | TDP1 (0.33) | — | |
| SCHEMBL29027260 | 0.79 | — | — | |
| SCHEMBL3210792 | 0.79 | BACE1 (0.33) | PTPN1ALDH1A1 | |
| SCHEMBL9327083 | 0.79 | CA1 (0.38) | PTPN1ALDH1A1 | |
| SCHEMBL8009349 | 0.78 | ALDH1A1 (0.31) | ALDH1A1GLA | |
| SCHEMBL275849 | 0.77 | — | — |
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-6048863-A | SEXUAL DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2000-04-11 | — | — | US | disclosed |