Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | VDR | P11473 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | PSMD10 | O75832 | 1/20 | 0.34 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8518530 | 0.94 | CA12 (0.34) | CA12CA1CA9HTR6VDR | |
| SCHEMBL9690321 | 0.85 | CA12 (0.34) | CA12CA1CA9HTR6VDR | |
| SCHEMBL12676668 | 0.78 | MEN1 (0.51) | CA12CA1CA9VDRALDH1A1 | |
| SCHEMBL18926552 | 0.77 | PSMD10 (0.45) | CA12CA1CA9VDRALDH1A1 | |
| SCHEMBL17320652 | 0.76 | HTR6 (0.52) | HTR6VDRALDH1A1MEN1KMT2A | |
| SCHEMBL2568984 | 0.76 | ALDH1A1 (0.48) | CA12CA1CA9VDRALDH1A1 | |
| SCHEMBL1904847 | 0.76 | VDR (0.40) | CA12CA1CA9VDRALDH1A1 | |
| SCHEMBL28774223 | 0.76 | MEN1 (0.46) | CA12CA1CA9VDRTAAR1 | |
| SCHEMBL5748460 | 0.76 | LMNA (0.48) | CA12CA1CA9VDRALDH1A1 | |
| SCHEMBL8209789 | 0.76 | TP53 (0.51) | VDRALDH1A1TAAR1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5883102-A | Pharmaceutically active compounds | ASTRA PHARMACEUTICALS LIMITED (GB) | 1999-03-16 | — | — | US | disclosed |
| EP-0858451-A1 | PHARMACEUTICALLY ACTIVE QUINAZOLINE COMPOUNDS | Astra Pharmaceuticals Limited (GB) | 1998-08-19 | — | — | EP | disclosed |
| WO-1997014686-A1 | PHARMACEUTICALLY ACTIVE QUINAZOLINE COMPOUNDS | ASTRA PHARMACEUTICALS LIMITED (GB) | 1997-04-24 | — | — | WO | disclosed |