Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 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 | |
|---|---|---|---|---|
| SCHEMBL28816343 | 0.86 | ALDH1A1 (0.45) | ALDH1A1LMNARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL27906710 | 0.83 | LMNA (0.42) | ALDH1A1LMNATSHRHSD17B10CA1 | |
| SCHEMBL15567828 | 0.80 | RAB9A (0.38) | ALDH1A1TSHRHSD17B10TDP1CA12 | |
| SCHEMBL1566864 | 0.80 | CA12 (0.38) | ALDH1A1LMNATSHRHSD17B10TDP1 | |
| SCHEMBL163017 | 0.80 | CA12 (0.35) | ALDH1A1LMNATSHRHSD17B10TDP1 | |
| SCHEMBL27820699 | 0.79 | NR4A2 (0.43) | ALDH1A1LMNATSHRHSD17B10CA12 | |
| SCHEMBL7528684 | 0.76 | CA12 (0.38) | ALDH1A1LMNATSHRHSD17B10TDP1 | |
| SCHEMBL624330 | 0.76 | RAB9A (0.33) | ALDH1A1LMNATSHRHSD17B10TDP1 | |
| SCHEMBL28587355 | 0.76 | ALDH1A1 (0.36) | ALDH1A1ADRA1AADRA1BGRM6 | |
| SCHEMBL2425691 | 0.76 | KEAP1 (0.41) | ALDH1A1TSHRHSD17B10TDP1SMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |