Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MAOA | P21397 | 3/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | KAT7 | O95251 | 1/20 | 0.33 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29596569 | 0.89 | CYP3A4 (0.48) | CYP3A4MAPTKDM4EMAOACHRNA7 | |
| SCHEMBL28136192 | 0.82 | PIR (0.32) | PIK3CD | |
| SCHEMBL24869990 | 0.81 | POLB (0.40) | CYP3A4MAPTKDM4EMAOACHRNA7 | |
| SCHEMBL25946969 | 0.79 | CYP3A4 (0.43) | CYP3A4MAPTKDM4EMAOACHRNA7 | |
| SCHEMBL6174277 | 0.77 | MAPT (0.46) | CYP3A4MAPTKDM4EMAOACHRNA7 | |
| SCHEMBL361694 | 0.77 | MAPT (0.46) | CYP3A4MAPTKDM4EMAOACHRNA7 | |
| SCHEMBL24869680 | 0.74 | SIRT6 (0.41) | CYP3A4MAPTKDM4EALDH1A1 | |
| SCHEMBL22953307 | 0.72 | MAPT (0.71) | CYP3A4MAPTKDM4EMAOAGAA | |
| SCHEMBL12595457 | 0.72 | MAPT (0.71) | CYP3A4MAPTKDM4EMAOAGAA | |
| SCHEMBL12010114 | 0.72 | MAOA (0.67) | CYP3A4MAOACHRNA7MAOBSLC6A4 |
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-2023281417-A1 | PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS | GLENMARK SPECIALTY S.A. (CH) | 2023-01-12 | — | — | WO | disclosed |