Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CETP | P11597 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | SIRT2 | Q8IXJ6 | 6/20 | 0.47 |
| ▸ | SIRT1 | Q96EB6 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
| ▸ | SIRT3 | Q9NTG7 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27573384 | 1.00 | CA1 (0.55) | CA1CA2CETPALDH1A1CYP3A4 | |
| SCHEMBL28840647 | 1.00 | CA1 (0.55) | CA1CA2CETPALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL28380114 | 0.99 | CA1 (0.53) | CA1CA2CETPALDH1A1CYP3A4 | |
| SCHEMBL22501953 | 0.98 | CA1 (0.56) | CA1CA2CETPALDH1A1CYP3A4 | |
| SCHEMBL19024775 | 0.97 | CETP (0.54) | CA1CA2CETPALDH1A1CYP3A4 | |
| SCHEMBL19024799 | 0.97 | CETP (0.54) | CA1CA2CETPALDH1A1CYP3A4 | |
| SCHEMBL19024795 | 0.97 | CETP (0.54) | CA1CA2CETPALDH1A1CYP3A4 | |
| SCHEMBL19024834 | 0.97 | CETP (0.54) | CA1CA2CETPALDH1A1CYP3A4 | |
| SCHEMBL19024919 | 0.97 | CETP (0.54) | CA1CA2CETPALDH1A1CYP3A4 | |
| SCHEMBL19024672 | 0.97 | CETP (0.54) | CA1CA2CETPALDH1A1CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116829151-A | Azaquinazoline pan KRAS inhibitors | 米拉蒂治疗股份有限公司 | 2023-09-29 | — | — | CN | disclosed |
| WO-2010062821-A1 | ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE | GLAXOSMITHKLINE LLC (US) | 2010-06-03 | — | — | WO | disclosed |
| EP-2099778-A2 | AMIDO ANTI-VIRAL COMPOUNDS | Smithkline Beecham Corporation (US) | 2009-09-16 | — | — | EP | disclosed |
| WO-2008064218-A2 | AMIDO ANTI-VIRAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-05-29 | — | — | WO | disclosed |