Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC1 | P33527 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.41 |
| ▸ | CASR | P41180 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MAT2A | P31153 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.38 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.38 |
| ▸ | F11 | P03951 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7492606 | 0.89 | ABCC1 (0.41) | ABCC1PTGER4MAT2A | |
| SCHEMBL5878178 | 0.89 | EGFR (0.46) | ABCC1ALDH1A1SMN1; SMN2LMNACTSD | |
| SCHEMBL5878138 | 0.89 | CYP2D6 (0.42) | ABCC1EGFR | |
| SCHEMBL5877961 | 0.87 | ABCC1 (0.56) | ABCC1ALDH1A1PTGER4CASRSMN1; SMN2 | |
| SCHEMBL5878320 | 0.86 | ABCC1 (0.62) | ABCC1ALDH1A1TSHRCASRSMN1; SMN2 | |
| SCHEMBL5877050 | 0.86 | ABCC1 (0.62) | ABCC1ALDH1A1TSHRCASRSMN1; SMN2 | |
| SCHEMBL5877889 | 0.86 | F11 (0.43) | ABCC1PTGER4F11 | |
| SCHEMBL5878155 | 0.85 | ABCC1 (0.52) | ABCC1ALDH1A1TSHRPTGER4CASR | |
| SCHEMBL5878372 | 0.84 | PDE1A (0.43) | ABCC1ALDH1A1LMNARAB9ACTSD | |
| SCHEMBL5878390 | 0.82 | ABCC1 (0.59) | ABCC1ALDH1A1TSHRCASRSMN1; SMN2 |
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-7060706-B1 | Quinazolinones | 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) | 2006-06-13 | — | — | US | disclosed |
| EP-1216233-A1 | QUINAZOLINONES | MERCK PATENT GmbH (DE) | 2002-06-26 | — | — | EP | disclosed |
| WO-2001023364-A1 | QUINAZOLINONES | MERCK PATENT GMBH (DE) | 2001-04-05 | — | — | WO | disclosed |