Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 5/20 | 0.42 |
| ▸ | ABAT | P80404 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29875339 | 1.00 | HRH3 (0.43) | HRH3LOXL2ABATCA1CA2 | |
| SCHEMBL5705931 | 0.80 | TAAR1 (0.56) | CA1CA2PNMTCA12CA4 | |
| SCHEMBL13443566 | 0.80 | HRH3 (0.40) | HRH3LOXL2ABATCA1CA2 | |
| SCHEMBL30496702 | 0.80 | TAAR1 (0.56) | CA1CA2PNMTCA12CA4 | |
| SCHEMBL11441801 | 0.80 | LOXL2 (0.44) | HRH3LOXL2ABATCA1CA2 | |
| SCHEMBL1363230 | 0.78 | CSNK2A1 (0.46) | HRH3LOXL2PNMTCYP2A6TAAR1 | |
| SCHEMBL3400966 | 0.78 | KDM4E (0.47) | HRH3LOXL2ABATCA1CA2 | |
| SCHEMBL3398586 | 0.78 | HRH3 (0.39) | HRH3LOXL2ABATCA1CA2 | |
| SCHEMBL51845 | 0.78 | KDM4E (0.47) | HRH3LOXL2ABATCA1CA2 | |
| SCHEMBL5441282 | 0.78 | ALOX15 (0.50) | ABATCA1CA2ENPP2CA12 |
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-114956933-A | Marker containing isotope oxygen atom and preparation method and application thereof | 清华大学 | 2022-08-30 | — | — | CN | disclosed |