Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 1/20 | 0.57 |
| ▸ | LIPC | P11150 | 1/20 | 0.52 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.52 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.51 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | APAF1 | O14727 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | CASP6 | P55212 | 1/20 | 0.51 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.51 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.51 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.51 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | DHODH | Q02127 | 2/20 | 0.49 |
| ▸ | TAS2R14 | Q9NYV8 | 2/20 | 0.49 |
| ▸ | SCN8A | Q9UQD0 | 3/20 | 0.48 |
| ▸ | SCN10A | Q9Y5Y9 | 3/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL30294712 | 1.00 | MPO (0.57) | MPOLIPCLIPGAKR1C3AKR1C2 | |
| SCHEMBL30294393 | 0.91 | AKR1C3 (0.52) | MPOLIPCLIPGAKR1C3AKR1C2 | |
| SCHEMBL30294635 | 0.88 | AKR1C3 (0.56) | LIPCLIPGAKR1C3AKR1C2KDM4E | |
| SCHEMBL22853081 | 0.88 | AKR1C3 (0.56) | LIPCLIPGAKR1C3AKR1C2KDM4E | |
| SCHEMBL30294858 | 0.85 | CDC25B (0.48) | MPORXFP1SCN8ASCN10AALDH1A1 | |
| SCHEMBL22853040 | 0.85 | CDC25B (0.48) | MPORXFP1SCN8ASCN10AALDH1A1 | |
| SCHEMBL22853126 | 0.84 | MPO (0.58) | MPOLIPCLIPGAKR1C3AKR1C2 | |
| SCHEMBL30294628 | 0.84 | MPO (0.58) | MPOLIPCLIPGAKR1C3AKR1C2 | |
| SCHEMBL22833319 | 0.83 | MPO (0.61) | MPOLIPCLIPGAKR1C3AKR1C2 | |
| SCHEMBL29383283 | 0.83 | MPO (0.61) | MPOLIPCLIPGAKR1C3AKR1C2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020261114-A1 | 2,3-DIHYDROQUINAZOLIN COMPOUNDS AS NAV1.8 INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2020-12-30 | — | — | WO | disclosed |