Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.43 |
| ▸ | SCN1A | P35498 | 2/20 | 0.43 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.43 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | LOX | P28300 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20789878 | 0.85 | CA1 (0.55) | CA1CA2CA9LOXL2MAOA | |
| SCHEMBL19308205 | 0.81 | NPY5R (0.44) | CA1CA2CA9SCN1ASCN2A | |
| SCHEMBL8898328 | 0.80 | NPY5R (0.62) | SCN1ASCN2ASCN3AALDH1A1KDM4E | |
| SCHEMBL6097914 | 0.79 | CA1 (0.52) | CA1CA2CA9LOXL2MAOA | |
| SCHEMBL3240747 | 0.77 | MEN1 (0.53) | CA1CA2CA9NPY5RCNR1 | |
| SCHEMBL19308202 | 0.76 | SLC6A2 (0.45) | CA2ALDH1A1HSD17B10NPY5RNPY1R | |
| SCHEMBL12929535 | 0.76 | HDAC3 (0.47) | CA1CA2CA9SCN1ASCN2A | |
| SCHEMBL19308198 | 0.75 | TSHR (0.47) | LOXL2ALDH1A1MAOALOXHDAC3 | |
| SCHEMBL8484443 | 0.75 | HTR6 (0.50) | CA1CA2CA9HTR6 | |
| SCHEMBL5126972 | 0.69 | NPY5R (0.64) | SCN1ASCN2ASCN3AALDH1A1KDM4E |
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-9752149-B2 | Matriptase inhibitors and uses thereof against orthomyxoviridae infections | SOCPRA Sciences Sante et Humaines S.E.C. (CA) | 2017-09-05 | — | — | US | disclosed |