Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.53 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 3/20 | 0.46 |
| ▸ | HTR2A | P28223 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.44 |
| ▸ | HTR3B | O95264 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | HTR3A | P46098 | 1/20 | 0.44 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.44 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11866288 | 1.00 | PIK3CA (0.53) | PIK3CAHTR6HTR2CHTR2ASLC6A4 | |
| SCHEMBL11860847 | 0.92 | PIK3CA (0.59) | PIK3CAALDH1A1HRH4KDM4EHPGD | |
| Fumaric Acid SCHEMBL11850350 | 0.90 | PIK3CA (0.48) | PIK3CAHTR6HTR2CHTR2ASLC6A4 | |
| Maleic Acid SCHEMBL11850337 | 0.90 | PIK3CA (0.48) | PIK3CAHTR6HTR2CHTR2ASLC6A4 | |
| SCHEMBL11849344 | 0.87 | GLA (0.52) | HTR6HTR2CHTR2ASLC6A4HTR3E | |
| Hydrochloric Acid SCHEMBL11860215 | 0.86 | GLA (0.51) | HTR6HTR2CHTR2ASLC6A4HTR3E | |
| Hydrochloric Acid SCHEMBL11862975 | 0.86 | PIK3CA (0.54) | PIK3CAALDH1A1HRH4KDM4EHPGD | |
| SCHEMBL11856434 | 0.85 | HRH4 (0.63) | PIK3CAHTR2CHTR2AHTR3EHTR3B | |
| SCHEMBL11862561 | 0.85 | PIK3CA (0.56) | PIK3CAALDH1A1KDM4EHPGD | |
| Hydrochloric Acid SCHEMBL11852640 | 0.84 | KDM4E (0.55) | PIK3CAALDH1A1KDM4EHPGD |
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 |