Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3081057 | 0.89 | CYP3A4 (0.53) | ADORA3CYP2D6MEN1KMT2ACYP3A4 | |
| SCHEMBL3090418 | 0.88 | SCD5 (0.52) | APPCYP2D6MEN1KMT2AHPGD | |
| SCHEMBL16628712 | 0.87 | ADORA3 (0.56) | APPADORA3 | |
| SCHEMBL16628770 | 0.86 | HPGD (0.55) | APPADORA3CYP2D6MEN1KMT2A | |
| SCHEMBL16628737 | 0.85 | TACR1 (0.54) | APP | |
| SCHEMBL13144374 | 0.83 | AOC3 (0.46) | CYP2D6MEN1KMT2ACYP3A4HSP90AA1 | |
| SCHEMBL16628767 | 0.83 | CYP3A4 (0.48) | ADORA3CYP2D6MEN1KMT2ALMNA | |
| SCHEMBL16628717 | 0.82 | LMNA (0.50) | CYP2D6MEN1KMT2ALMNACYP1A2 | |
| SCHEMBL3087920 | 0.81 | ADORA3 (0.52) | APPADORA3MEN1KMT2ACYP1A2 | |
| SCHEMBL3087952 | 0.81 | APP (0.48) | APPKMT2A |
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-2164833-B1 | Quinazolinamide derivatives useful for the treatment of tumour diseases | MERCK PATENT GMBH (DE) | 2015-04-15 | — | — | EP | claimed |
| EP-2164833-B1 | Quinazolinamide derivatives useful for the treatment of tumour diseases | MERCK PATENT GMBH (DE) | 2015-04-15 | — | — | EP | disclosed |