Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | PDE7A | Q13946 | 4/20 | 0.55 |
| ▸ | PDE7B | Q9NP56 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | G6PD | P11413 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10550539 | 0.86 | HTT (0.76) | HTTKDM4EPDE7APDE7BMEN1 | |
| SCHEMBL2680534 | 0.75 | PDE7A (0.75) | HTTKDM4EPDE7APDE7BMEN1 | |
| SCHEMBL30656413 | 0.75 | PDE7A (0.75) | HTTKDM4EPDE7APDE7BMEN1 | |
| SCHEMBL299573 | 0.72 | PDE7A (1.00) | HTTKDM4EPDE7APDE7BMEN1 | |
| SCHEMBL30193439 | 0.72 | PDE7A (1.00) | HTTKDM4EPDE7APDE7BMEN1 | |
| SCHEMBL10517908 | 0.71 | APAF1 (0.44) | HTTKDM4EPDE7AALOX12NPSR1 | |
| SCHEMBL10559676 | 0.71 | KDM4E (0.74) | HTTKDM4EMEN1KMT2AMAPT | |
| SCHEMBL21436060 | 0.69 | ALOX12 (0.70) | HTTKDM4EPDE7APDE7BMEN1 | |
| SCHEMBL6283505 | 0.68 | PDE7A (0.77) | HTTKDM4EPDE7APDE7BMEN1 | |
| SCHEMBL299166 | 0.67 | PDE7A (1.00) | HTTKDM4EPDE7APDE7BMEN1 |
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-4824469-A | PHENYL-, (1,2,4-TRIAZOL-1-YL- OR IMIDAZOL-1-YL-) QUINAZOLIN-4-(ONE OR THIONE) | SCHERING AGROCHEMICALS LTD. (GB) | 1989-04-25 | — | — | US | disclosed |
| US-4731106-A | Fungicidal azole compounds | SCHERING AGROCHEMICALS LIMITED (GB) | 1988-03-15 | — | — | US | disclosed |
| EP-0183458-A1 | Fungicidal azole compounds | SCHERING AGROCHEMICALS LIMITED (GB) | 1986-06-04 | — | — | EP | disclosed |