Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.40 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | OGA | O60502 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20469098 | 0.91 | GRIN2D (0.40) | MAP3K12PDE10AGRIN2DGRIN3BGRIN1 | |
| SCHEMBL21012663 | 0.91 | PDE10A (0.38) | MAP3K12PDE10AGRIN2DGRIN3BGRIN1 | |
| SCHEMBL20468999 | 0.91 | PDE10A (0.38) | MAP3K12PDE10AGRIN2DGRIN3BGRIN1 | |
| SCHEMBL21450070 | 0.87 | GRIN2D (0.42) | PDE10AGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL20468981 | 0.86 | GRM5 (0.39) | MAP3K12 | |
| SCHEMBL20456800 | 0.83 | MAP3K12 (0.43) | MAP3K12DRD3HTR1ADRD2DRD4 | |
| SCHEMBL24018500 | 0.83 | MAP3K12 (0.43) | MAP3K12DRD3HTR1ADRD2DRD4 | |
| SCHEMBL20469202 | 0.83 | MAP3K12 (0.46) | MAP3K12DRD3HTR1ADRD2DRD4 | |
| SCHEMBL21675879 | 0.81 | MAP3K12 (0.41) | MAP3K12GPR119DHFRMEN1KMT2A | |
| SCHEMBL21588382 | 0.80 | PDE10A (0.44) | PDE10AGRIN2DGRIN3BGRIN1GRIN2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3909949-A1 | ATAZANAVIR (ATV) ANALOGUES FOR TREATING HIV INFECTIONS | Gilead Sciences, Inc. (US) | 2021-11-17 | — | — | EP | disclosed |