Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | P2RX3 | P56373 | 12/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9196438 | 0.91 | P2RX3 (0.44) | P2RX3HPGD | |
| SCHEMBL9202880 | 0.91 | P2RX3 (0.49) | P2RX3 | |
| SCHEMBL9195065 | 0.90 | ALDH1A1 (0.43) | ALDH1A1P2RX3HPGDCYP3A4 | |
| SCHEMBL9202886 | 0.88 | ALDH1A1 (0.38) | ALDH1A1P2RX3CYP3A4L3MBTL1 | |
| SCHEMBL10333434 | 0.84 | KDM4E (0.39) | ALDH1A1L3MBTL1 | |
| SCHEMBL9196048 | 0.80 | P2RX3 (0.43) | P2RX3HPGDP2RX7CYP3A4 | |
| SCHEMBL10557407 | 0.80 | MEN1 (0.47) | P2RX3HPGD | |
| SCHEMBL10559207 | 0.79 | P2RX3 (0.49) | P2RX3 | |
| SCHEMBL9197469 | 0.76 | HPGD (0.51) | P2RX3HPGDP2RX7CYP3A4 | |
| SCHEMBL9196436 | 0.73 | P2RX3 (0.44) | P2RX3HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0383465-B1 | Tricyclic fused pyrimidine derivatives, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1995-05-03 | — | — | EP | disclosed |
| US-5032594-A | Adenosine antagonist | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1991-07-16 | — | — | US | disclosed |
| EP-0383465-A2 | Tricyclic fused pyrimidine derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1990-08-22 | — | — | EP | disclosed |