Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 9/20 | 0.38 |
| ▸ | CDC25B | P30305 | 8/20 | 0.38 |
| ▸ | PDE2A | O00408 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | PTPN2 | P17706 | 5/20 | 0.36 |
| ▸ | PTPN6 | P29350 | 4/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 4/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.36 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.36 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.36 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.36 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.36 |
| ▸ | TACR2 | P21452 | 1/20 | 0.36 |
| ▸ | NT5E | P21589 | 1/20 | 0.35 |
| ▸ | GJB2 | P29033 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17106780 | 1.00 | HTR1A (0.41) | HTR1APTPN1CDC25BPDE2ABCHE | |
| SCHEMBL17106778 | 1.00 | HTR1A (0.41) | HTR1APTPN1CDC25BPDE2ABCHE | |
| SCHEMBL19343951 | 1.00 | HTR1A (0.41) | HTR1APTPN1CDC25BPDE2ABCHE | |
| SCHEMBL22002160 | 1.00 | HTR1A (0.41) | HTR1APTPN1CDC25BPDE2ABCHE | |
| SCHEMBL17106842 | 0.86 | HTR1A (0.41) | HTR1APTPN1CDC25BPDE2ABCHE | |
| SCHEMBL17106843 | 0.86 | HTR1A (0.41) | HTR1APTPN1CDC25BPDE2ABCHE | |
| SCHEMBL29937393 | 0.85 | HTR1A (0.43) | HTR1APTPN1CDC25BPDE2ABCHE | |
| SCHEMBL17106818 | 0.85 | HTR1A (0.43) | HTR1APTPN1CDC25BPDE2ABCHE | |
| SCHEMBL29937871 | 0.85 | HTR1A (0.43) | HTR1APTPN1CDC25BPDE2ABCHE | |
| SCHEMBL25598746 | 0.85 | HTR1A (0.43) | HTR1APTPN1CDC25BPDE2ABCHE |
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-111233869-B | Novel compound for preparing Rudexilvir key intermediate and preparation method thereof | 杭州新博思生物医药有限公司 | 2022-09-16 | — | — | CN | disclosed |