Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.38 |
| ▸ | HPD | P32754 | 7/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20060183 | 0.87 | NPC1 (0.35) | HPD | |
| SCHEMBL20060194 | 0.83 | ALDH1A1 (0.37) | HPD | |
| SCHEMBL20060133 | 0.78 | HPD (0.34) | P2RX7HPD | |
| SCHEMBL20060137 | 0.77 | P2RX7 (0.36) | P2RX7TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL20060196 | 0.77 | CTSD (0.39) | HPD | |
| SCHEMBL20059994 | 0.77 | NPC1 (0.36) | — | |
| SCHEMBL20060177 | 0.74 | HPD (0.36) | HPD | |
| SCHEMBL20059914 | 0.74 | HPD (0.40) | P2RX7HPD | |
| SCHEMBL20059923 | 0.74 | HPD (0.40) | P2RX7HPD | |
| SCHEMBL20060130 | 0.72 | GRIN1 (0.40) | P2RX7TAS1R3TAS1R1TAS1R2HPD |
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 |
|---|---|---|---|---|---|---|---|
| EP-2595987-B1 | NEW AMINOPYRAZOLOQUINAZOLINES | BOEHRINGER INGELHEIM INT (DE) | 2018-04-18 | — | — | EP | disclosed |