Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | LOXL2 | Q9Y4K0 | 7/20 | 0.48 |
| ▸ | ABAT | P80404 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | F11 | P03951 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 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 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL25435922 | 0.78 | HRH3 (0.55) | HRH3LOXL2ABATTAAR1CA1 | |
| SCHEMBL15828 | 0.76 | HRH3 (0.79) | HRH3LOXL2ABATTAAR1CA1 | |
| SCHEMBL11250295 | 0.76 | NR1H2 (0.32) | MAPT | |
| SCHEMBL7643258 | 0.76 | HRH3 (0.52) | HRH3LOXL2ABATTAAR1CA1 | |
| SCHEMBL18410918 | 0.74 | LOXL2 (0.52) | HRH3LOXL2ABATTAAR1CA1 | |
| SCHEMBL9303786 | 0.74 | TRPA1 (0.43) | — | |
| SCHEMBL2018103 | 0.74 | TP53 (0.43) | TAAR1CA2 | |
| SCHEMBL23891959 | 0.74 | ABAT (0.52) | HRH3LOXL2ABATTAAR1CA1 | |
| SCHEMBL2092148 | 0.74 | SLC6A4 (0.61) | HRH3LOXL2ABAT | |
| SCHEMBL5790074 | 0.73 | MAOB (0.52) | HRH3LOXL2TAAR1PNMTMAOB |
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 |