Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC25B | P30305 | 2/20 | 0.50 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 6/20 | 0.45 |
| ▸ | AKR1C2 | P52895 | 6/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL30294267 | 1.00 | CDC25B (0.50) | CDC25BP2RX7AKR1C3AKR1C2ALDH1A1 | |
| SCHEMBL30294387 | 0.85 | ALDH1A1 (0.44) | CDC25BALDH1A1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL30294718 | 0.85 | AKR1C3 (0.63) | AKR1C3AKR1C2 | |
| SCHEMBL22853342 | 0.85 | AKR1C3 (0.63) | AKR1C3AKR1C2 | |
| SCHEMBL22853397 | 0.84 | MAPT (0.49) | ALDH1A1KDM4ESMN1; SMN2LMNAPOLB | |
| SCHEMBL30294784 | 0.84 | MAPT (0.49) | ALDH1A1KDM4ESMN1; SMN2LMNAPOLB | |
| SCHEMBL22833395 | 0.82 | KDM4E (0.46) | KDM4ESMN1; SMN2LMNAPOLBTDP1 | |
| SCHEMBL29382578 | 0.82 | KDM4E (0.46) | KDM4ESMN1; SMN2LMNAPOLBTDP1 | |
| SCHEMBL10834109 | 0.81 | CDC25B (0.65) | CDC25BP2RX7AKR1C3AKR1C2ALDH1A1 | |
| SCHEMBL22853336 | 0.81 | SMN1; SMN2 (0.42) | ALDH1A1HPGDKDM4EGAASMN1; 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 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 |