Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 4/20 | 0.50 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.50 |
| ▸ | WHR1 | P49842 | 1/20 | 0.49 |
| ▸ | RORB | Q92753 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | KRAS | P01116 | 1/20 | 0.47 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 4/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.45 |
| ▸ | CSF1R | P07333 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7801624 | 0.83 | ADORA2A (0.56) | ADORA2AADORA1WHR1EGFRPDE4B | |
| SCHEMBL30759714 | 0.82 | WHR1 (0.71) | ADORA2AADORA1WHR1NPSR1KDM4E | |
| SCHEMBL1257435 | 0.82 | WHR1 (0.71) | ADORA2AADORA1WHR1NPSR1KDM4E | |
| SCHEMBL5793277 | 0.81 | PDE4A (0.54) | ADORA2AADORA1WHR1EGFRPDE4B | |
| SCHEMBL1942672 | 0.81 | EGFR (0.61) | ADORA2AABCG2WHR1KRASSOS1 | |
| SCHEMBL7800408 | 0.81 | WHR1 (0.52) | ADORA2AWHR1EGFRPDE4B | |
| SCHEMBL7799250 | 0.77 | ADORA2A (0.53) | ADORA2AADORA1WHR1EGFR | |
| SCHEMBL16502038 | 0.76 | ABCG2 (0.52) | ADORA2AABCG2WHR1ALDH1A1PDE4B | |
| SCHEMBL29470281 | 0.74 | PDE4A (0.55) | ADORA2AADORA1WHR1KDM4EALDH1A1 | |
| SCHEMBL7666280 | 0.74 | HSP90AB1 (0.58) | ADORA2AADORA1WHR1EGFR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1162974-A1 | QUINAZOLINE FORMULATIONS AND THERAPEUTIC USE THEREOF | Parker Hughes Institute (US) | 2001-12-19 | — | — | EP | disclosed |
| EP-1163228-A1 | QUINAZOLINES AND THERAPEUTIC USE THEREOF | Parker Hughes Institute (US) | 2001-12-19 | — | — | EP | disclosed |
| WO-2000056338-A1 | QUINAZOLINE FORMULATIONS AND THERAPEUTIC USE THEREOF | PARKER HUGHES INSTITUTE (US) | 2000-09-28 | — | — | WO | disclosed |
| WO-2000056720-A1 | QUINAZOLINES AND THERAPEUTIC USE THEREOF | PARKER HUGHES INSTITUTE (US) | 2000-09-28 | — | — | WO | disclosed |