Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 13/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL9196436 | 0.91 | P2RX3 (0.44) | P2RX3HPGDADORA3 | |
| SCHEMBL9202874 | 0.91 | P2RX3 (0.48) | P2RX3 | |
| SCHEMBL9202879 | 0.88 | ALDH1A1 (0.38) | P2RX3CYP3A4 | |
| SCHEMBL10333850 | 0.84 | CNR2 (0.35) | P2RX3ADORA2A | |
| SCHEMBL10560072 | 0.81 | P2RX3 (0.45) | P2RX3HPGDADORA3 | |
| SCHEMBL9196053 | 0.80 | ALDH1A1 (0.44) | P2RX3HPGDP2RX7CYP3A4 | |
| SCHEMBL9197469 | 0.75 | HPGD (0.51) | P2RX3HPGDP2RX7CYP3A4ADORA3 | |
| SCHEMBL9196438 | 0.73 | P2RX3 (0.44) | P2RX3HPGDADORA3 | |
| SCHEMBL9202880 | 0.71 | P2RX3 (0.49) | P2RX3 | |
| SCHEMBL9195065 | 0.71 | ALDH1A1 (0.43) | P2RX3HPGDCYP3A4ADORA3 |
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 |