Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 5/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.45 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.45 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | PTGIR | P43119 | 1/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17041372 | 0.78 | GAA (0.51) | SLC6A4SLC6A3GRIN1GRIN2AGRIN2B | |
| SCHEMBL22701061 | 0.74 | SLC6A4 (0.41) | SLC6A4SLC6A3 | |
| SCHEMBL9322185 | 0.73 | TSHR (0.37) | GAACA1CA2CA9PTGIR | |
| SCHEMBL7310236 | 0.71 | HSD11B1 (0.44) | CA1CA2ALDH1A1HPGD | |
| SCHEMBL8425309 | 0.70 | CYP3A4 (0.39) | SLC6A4SLC6A3PTGIRSLC6A2ALDH1A1 | |
| SCHEMBL10086337 | 0.69 | SLC6A4 (0.58) | SLC6A4SLC6A3GRIN1GRIN2AGRIN2B | |
| SCHEMBL10112733 | 0.69 | SLC6A4 (0.58) | SLC6A4SLC6A3GRIN1GRIN2AGRIN2B | |
| SCHEMBL10112736 | 0.69 | SLC6A4 (0.58) | SLC6A4SLC6A3GRIN1GRIN2AGRIN2B | |
| SCHEMBL10112726 | 0.69 | SLC6A4 (0.58) | SLC6A4SLC6A3GRIN1GRIN2AGRIN2B | |
| SCHEMBL19268518 | 0.69 | SLC6A4 (0.58) | SLC6A4SLC6A3GRIN1GRIN2AGRIN2B |
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-4111873-A | DITHIO COMPOUNDS | AMERICAN CYANAMID COMPANY (US) | 1978-09-05 | — | — | US | disclosed |