Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GJB2 | P29033 | 2/20 | 0.42 |
| ▸ | NT5E | P21589 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.38 |
| ▸ | FGF2 | P09038 | 1/20 | 0.38 |
| ▸ | MDK | P21741 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CDC25B | P30305 | 1/20 | 0.37 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.37 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.37 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.37 |
| ▸ | 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 |
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | SELP | P16109 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22073763 | 0.89 | NT5E (0.51) | GJB2NT5EPTPN1CYP2D6CDC25B | |
| SCHEMBL12729487 | 0.88 | CYP2D6 (0.39) | GJB2NT5EFGF2MDKCYP2D6 | |
| SCHEMBL22073056 | 0.87 | NT5E (0.53) | NT5EPTPN1CYP2D6ALDH1A1MAPK1 | |
| SCHEMBL6952985 | 0.86 | GJB2 (0.43) | GJB2NT5EPTPN1FGF2MDK | |
| SCHEMBL22315183 | 0.85 | NT5E (0.55) | NT5EPTPN1CYP2D6CDC25BPTPN2 | |
| SCHEMBL2449623 | 0.84 | CYP2D6 (0.47) | NT5EPTPN1CYP2D6ALDH1A1MAPK1 | |
| SCHEMBL16317730 | 0.84 | CYP2D6 (0.47) | NT5EPTPN1CYP2D6ALDH1A1MAPK1 | |
| SCHEMBL7516237 | 0.84 | CYP2D6 (0.47) | NT5EPTPN1CYP2D6ALDH1A1MAPK1 | |
| SCHEMBL24672154 | 0.83 | NT5E (0.53) | NT5EPTPN1CDC25BPTPN2PTPN11 | |
| SCHEMBL2485383 | 0.83 | NT5E (0.53) | NT5EPTPN1CDC25BPTPN2PTPN11 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020114418-A1 | ANTICOAGULANT PENTASACCHARIDE COMPOUND, COMPOSITION, AND PREPARATION METHOD AND MEDICAL USE THEREOF | 南京正大天晴制药有限公司 | 2020-06-11 | — | — | WO | disclosed |