Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 13/20 | 0.71 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.57 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.57 |
| ▸ | FLT1 | P17948 | 5/20 | 0.56 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.54 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.54 |
| ▸ | RET | P07949 | 1/20 | 0.53 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.52 |
| ▸ | KDM1A | O60341 | 1/20 | 0.51 |
| ▸ | KDR | P35968 | 1/20 | 0.50 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.49 |
| ▸ | RAF1 | P04049 | 1/20 | 0.49 |
| ▸ | BRAF | P15056 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8976476 | 0.99 | EGFR (0.70) | EGFRNPC1NCOA1NCOA3FLT1 | |
| SCHEMBL8093519 | 0.83 | EGFR (1.00) | EGFRFLT1PIK3CAPIK3CGERBB2 | |
| SCHEMBL1733829 | 0.82 | EGFR (0.76) | EGFRFLT1PIK3CAPIK3CGRET | |
| Hydrochloric Acid SCHEMBL8976531 | 0.82 | EGFR (0.71) | EGFRNPC1NCOA1NCOA3FLT1 | |
| SCHEMBL3606262 | 0.81 | EGFR (0.73) | EGFRFLT1PIK3CAPIK3CGERBB2 | |
| Hydrochloric Acid SCHEMBL8593958 | 0.80 | EGFR (0.72) | EGFRNPC1FLT1KDR | |
| SCHEMBL7537238 | 0.79 | EGFR (0.67) | EGFRFLT1PIK3CAPIK3CGRET | |
| SCHEMBL8561433 | 0.78 | RET (0.83) | EGFRFLT1RETERBB2KDR | |
| SCHEMBL7127039 | 0.78 | FLT1 (0.76) | EGFRFLT1KDM1AKDR | |
| SCHEMBL31514622 | 0.78 | EGFR (0.69) | EGFRFLT1PIK3CAPIK3CGRET |
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-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-0602851-A1 | Quinazoline derivatives | ZENECA LIMITED (GB) | 1994-06-22 | — | — | EP | disclosed |