Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 3/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | HAVCR2 | Q8TDQ0 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29646335 | 1.00 | XDH (0.39) | XDHADORA3HAVCR2 | |
| SCHEMBL22988015 | 0.89 | XDH (0.41) | XDHADORA3HAVCR2 | |
| SCHEMBL22988092 | 0.87 | XDH (0.41) | XDHADORA3HAVCR2 | |
| SCHEMBL22987948 | 0.83 | GABRP (0.54) | ADORA3HAVCR2 | |
| SCHEMBL22987643 | 0.81 | HSD11B1 (0.35) | — | |
| SCHEMBL22987735 | 0.80 | XDH (0.55) | XDH | |
| SCHEMBL22979408 | 0.78 | XDH (0.41) | XDHADORA3HAVCR2 | |
| SCHEMBL29646387 | 0.78 | XDH (0.41) | XDHADORA3HAVCR2 | |
| SCHEMBL22987718 | 0.75 | SMN1; SMN2 (0.40) | XDHHAVCR2 | |
| SCHEMBL29645469 | 0.75 | P2RX7 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021028382-A1 | [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES | BAYER AKTIENGESELLSCHAFT (DE) | 2021-02-18 | — | — | WO | disclosed |