Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | PDE4A | P27815 | 2/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.49 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.49 |
| ▸ | HRH1 | P35367 | 1/20 | 0.49 |
| ▸ | HTR2C | P28335 | 2/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | CASP4 | P49662 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11860215 | 0.99 | GLA (0.51) | GLATSHRHSD17B10GAAHPGD | |
| SCHEMBL11866288 | 0.87 | PIK3CA (0.53) | HPGDHTR2CHTR2ASLC6A4HTR6 | |
| SCHEMBL11862561 | 0.87 | PIK3CA (0.56) | GLAGAAHPGDKDM4EALDH1A1 | |
| SCHEMBL11849800 | 0.87 | PIK3CA (0.53) | HPGDHTR2CHTR2ASLC6A4HTR6 | |
| Hydrochloric Acid SCHEMBL11852640 | 0.86 | KDM4E (0.55) | GLAGAAHPGDKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL11862975 | 0.83 | PIK3CA (0.54) | GLATSHRHSD17B10GAAHPGD | |
| SCHEMBL30576164 | 0.80 | HTR2C (0.51) | GLATSHRHSD17B10GAAHPGD | |
| Maleic Acid SCHEMBL11850337 | 0.79 | PIK3CA (0.48) | HSD17B10HPGDHTR2CHTR2ASLC6A4 | |
| Fumaric Acid SCHEMBL11850350 | 0.79 | PIK3CA (0.48) | HSD17B10HPGDHTR2CHTR2ASLC6A4 | |
| Hydrochloric Acid SCHEMBL25431780 | 0.78 | ALDH1A1 (0.53) | GLATSHRHSD17B10GAAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-3939268-A | 2,4-Diamino substituted pyridol(3,2-d)pyrimidine as antithrombotic agents | BOEHRINGER INGELHEIM GMBH (DT) | 1976-02-17 | — | — | US | disclosed |