Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F11 | P03951 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | AVPR1B | P47901 | 5/20 | 0.45 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.45 |
| ▸ | GHSR | Q92847 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5877563 | 0.96 | F11 (0.50) | F11KCNH2HRH3ADRA1AABCC1 | |
| SCHEMBL5877069 | 0.95 | F11 (0.49) | F11KCNH2HRH3ADRA1AABCC1 | |
| SCHEMBL5877978 | 0.95 | AVPR1B (0.49) | F11KCNH2HRH3ADRA1AABCC1 | |
| SCHEMBL5877637 | 0.94 | F11 (0.49) | F11KCNH2HRH3ADRA1AABCC1 | |
| SCHEMBL5877963 | 0.94 | ALDH1A1 (0.47) | F11KCNH2HRH3ADRA1AABCC1 | |
| SCHEMBL5877009 | 0.93 | F11 (0.47) | F11KCNH2HRH3ADRA1AABCC1 | |
| SCHEMBL5877807 | 0.93 | F11 (0.47) | F11KCNH2HRH3ADRA1AABCC1 | |
| SCHEMBL5877561 | 0.93 | CYP2D6 (0.46) | F11KCNH2HRH3ADRA1AABCC1 | |
| SCHEMBL5877568 | 0.92 | F11 (0.46) | F11KCNH2HRH3ADRA1AABCC1 | |
| SCHEMBL5877542 | 0.92 | F11 (0.46) | F11KCNH2HRH3ADRA1AABCC1 |
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 |