Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 4/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | ABAT | P80404 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL27717593 | 0.75 | ALDH1A1 (0.47) | LOXL2PNMTCYP2A6MAPTCSNK2A1 | |
| SCHEMBL14081606 | 0.75 | ABAT (0.43) | HRH3LOXL2CA1CA2ABAT | |
| SCHEMBL28958238 | 0.75 | HRH3 (0.43) | HRH3LOXL2CA1CA2ABAT | |
| SCHEMBL29875339 | 0.75 | HRH3 (0.43) | HRH3LOXL2CA1CA2ABAT | |
| SCHEMBL9983346 | 0.73 | HSP90AA1 (0.41) | CA1CA2CA9CYP2A6GAA | |
| Bromide SCHEMBL20984192 | 0.71 | HSP90AA1 (0.39) | CA1CA2CA9CYP2A6GAA | |
| Hydrochloric Acid SCHEMBL8660551 | 0.71 | HSP90AA1 (0.39) | CA1CA2CA9CYP2A6GAA | |
| SCHEMBL967725 | 0.70 | CSNK2A1 (0.39) | HRH3LOXL2CA1CA2ABAT | |
| SCHEMBL855443 | 0.70 | LOXL2 (0.46) | HRH3LOXL2CA1CA2ABAT | |
| SCHEMBL13163675 | 0.70 | ABAT (0.46) | HRH3CA1CA2ABATENPP2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102464654-B | Antiviral compound | PHARMARESOURCES (SHANGHAI) CO., LTD. (CN) | 2016-01-13 | — | — | CN | disclosed |