Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.48 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.48 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.48 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.48 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.48 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 9/20 | 0.47 |
| ▸ | PTPN2 | P17706 | 5/20 | 0.47 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.43 |
| ▸ | LGALS8 | O00214 | 1/20 | 0.42 |
| ▸ | CDC25B | P30305 | 6/20 | 0.41 |
| ▸ | CDC25A | P30304 | 2/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18825279 | 0.89 | BCHE (0.50) | BCHESSTR1SSTR2SSTR4SSTR3 | |
| SCHEMBL31064991 | 0.89 | BCHE (0.50) | BCHESSTR1SSTR2SSTR4SSTR3 | |
| SCHEMBL18825292 | 0.89 | BCHE (0.50) | BCHESSTR1SSTR2SSTR4SSTR3 | |
| SCHEMBL9699456 | 0.85 | PDPK1 (0.44) | BCHESSTR1SSTR2SSTR4SSTR3 | |
| SCHEMBL21233247 | 0.85 | PDPK1 (0.44) | BCHEPTPN1PTPN2PDPK1MTOR | |
| SCHEMBL14490101 | 0.85 | PDPK1 (0.44) | BCHEPTPN1PTPN2PDPK1MTOR | |
| SCHEMBL21233417 | 0.85 | SSTR1 (0.46) | BCHESSTR1SSTR2SSTR4SSTR3 | |
| SCHEMBL13956411 | 0.83 | TACR2 (0.47) | BCHESSTR1SSTR2SSTR4SSTR3 | |
| SCHEMBL22778376 | 0.83 | NT5E (0.39) | BCHESSTR1SSTR2SSTR4SSTR3 | |
| SCHEMBL19018767 | 0.83 | NT5E (0.39) | BCHESSTR1SSTR2SSTR4SSTR3 |
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-115477606-A | Method for quickly converting ester into alkyne | 中国科学院兰州化学物理研究所 | 2022-12-16 | — | — | CN | disclosed |