Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | APAF1 | O14727 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | CASP6 | P55212 | 1/20 | 0.52 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.52 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.52 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.52 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.52 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.52 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.52 |
| ▸ | CTSV | O60911 | 2/20 | 0.52 |
| ▸ | CTSL | P07711 | 2/20 | 0.52 |
| ▸ | DHODH | Q02127 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | PYGL | P06737 | 3/20 | 0.44 |
| ▸ | CDC25B | P30305 | 1/20 | 0.44 |
| ▸ | JAK1 | P23458 | 1/20 | 0.43 |
| ▸ | TYK2 | P29597 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30294307 | 1.00 | KDM4E (0.52) | KDM4EAPAF1RECQLCASP6CACNA1B | |
| SCHEMBL22853100 | 0.89 | KDM4E (0.46) | KDM4EAPAF1RECQLCASP6CACNA1B | |
| SCHEMBL30294920 | 0.89 | KDM4E (0.46) | KDM4EAPAF1RECQLCASP6CACNA1B | |
| SCHEMBL30294916 | 0.89 | KDM4E (0.46) | KDM4EAPAF1RECQLCASP6CACNA1B | |
| SCHEMBL22852839 | 0.84 | KDM4E (0.54) | KDM4EAPAF1RECQLCASP6CACNA1B | |
| SCHEMBL30294352 | 0.84 | KDM4E (0.54) | KDM4EAPAF1RECQLCASP6CACNA1B | |
| SCHEMBL4511303 | 0.82 | GAA (0.52) | CTSVCTSLDHODHCYP2C19MAPT | |
| SCHEMBL22853079 | 0.82 | MPO (0.57) | KDM4EAPAF1RECQLCASP6CACNA1B | |
| SCHEMBL30294712 | 0.82 | MPO (0.57) | KDM4EAPAF1RECQLCASP6CACNA1B | |
| SCHEMBL22853121 | 0.81 | IDO1 (0.48) | KDM4ECTSVCTSLDHODHMEN1 |
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 |