Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IP6K1 | Q92551 | 10/20 | 0.62 |
| ▸ | IP6K3 | Q96PC2 | 4/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | KIF11 | P52732 | 2/20 | 0.44 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.43 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.43 |
| ▸ | DNASE1 | P24855 | 1/20 | 0.43 |
| ▸ | FEN1 | P39748 | 1/20 | 0.43 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.43 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8976318 | 0.98 | IP6K1 (0.61) | IP6K1IP6K3HSD17B10ARKIF11 | |
| SCHEMBL8871223 | 0.86 | PIK3CD (0.60) | IP6K1IP6K3HSD17B10KIF11PIK3CD | |
| SCHEMBL23122450 | 0.78 | IP6K1 (0.60) | IP6K1IP6K3MAP4K4PIK3CDPIK3CA | |
| SCHEMBL8871369 | 0.77 | IP6K1 (1.00) | IP6K1IP6K3HSD17B10IP6K2MAP4K4 | |
| SCHEMBL1444275 | 0.76 | IP6K1 (0.59) | IP6K1IP6K3MAP4K4PIK3CDPIK3CA | |
| SCHEMBL14481463 | 0.75 | PIK3CD (0.65) | IP6K1IP6K3HSD17B10KIF11PIK3CD | |
| SCHEMBL27517100 | 0.75 | IP6K1 (0.64) | IP6K1IP6K3MAP4K4PIK3CDPIK3CA | |
| SCHEMBL8976326 | 0.75 | IP6K1 (1.00) | IP6K1IP6K3HSD17B10IP6K2PIK3CD | |
| SCHEMBL14877166 | 0.71 | KIF11 (0.47) | IP6K1ARKIF11 | |
| SCHEMBL1584889 | 0.71 | PIM1 (0.56) | MAP4K4MEN1ALDH1A1MAPTKMT2A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5616582-A | Use as anticancer agents; e.g. gefitinib | ZENECA LIMITED (GB) | 1997-04-01 | — | — | US | disclosed |
| US-5580870-A | ANTICARCINOGENIC AGENTS | ZENECA LIMITED (GB) | 1996-12-03 | — | — | US | disclosed |
| EP-0602851-B1 | Quinazoline derivatives | ZENECA LTD (GB) | 1996-10-09 | — | — | EP | disclosed |
| EP-0566226-B1 | Quinazoline derivatives | ZENECA LTD (GB) | 1995-11-08 | — | — | EP | disclosed |
| US-5457105-A | anticancer use; e.g. 4-(3'-chloro-4'-fluoroanilino)-6,7-dimethoxyquinazoline (gefitinib) | ZENECA LIMITED (GB) | 1995-10-10 | — | — | US | disclosed |
| EP-0602851-A1 | Quinazoline derivatives | ZENECA LIMITED (GB) | 1994-06-22 | — | — | EP | disclosed |
| EP-0566226-A1 | Quinazoline derivatives | ZENECA LIMITED (GB) | 1993-10-20 | — | — | EP | disclosed |