Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
| ▸ | APP | P05067 | 1/20 | 0.54 |
| ▸ | HSD17B2 | P37059 | 5/20 | 0.54 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | GBA1 | P04062 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16628815 | 0.88 | ADORA3 (0.58) | APPHSD17B2ADORA3ADORA2AMEN1 | |
| SCHEMBL3081057 | 0.86 | CYP3A4 (0.53) | ADORA3CYP3A4CYP2D6MEN1KMT2A | |
| SCHEMBL16628732 | 0.86 | APP (0.52) | HPGDAPPADORA3ADORA2ALMNA | |
| SCHEMBL3090418 | 0.85 | SCD5 (0.52) | HPGDAPPADORA2AALDH1A1CYP3A4 | |
| SCHEMBL16628737 | 0.82 | TACR1 (0.54) | APP | |
| SCHEMBL13144374 | 0.81 | AOC3 (0.46) | HSD17B2CYP3A4CYP2D6MEN1KMT2A | |
| SCHEMBL16628767 | 0.81 | CYP3A4 (0.48) | HPGDADORA3KDM4EALDH1A1LMNA | |
| SCHEMBL13144375 | 0.80 | ROCK1 (0.47) | ROCK1ADORA3ADORA2AKDM4EROCK2 | |
| SCHEMBL16628712 | 0.80 | ADORA3 (0.56) | APPADORA3ALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL16628717 | 0.79 | LMNA (0.50) | HPGDLMNAGBA1CYP3A4CYP2D6 |
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 |