Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SETD7 | Q8WTS6 | 2/20 | 0.47 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.42 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.42 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.42 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.38 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.38 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.38 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.38 |
| ▸ | SPR | P35270 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3392879 | 1.00 | SETD7 (0.47) | SETD7PDK1PDK2PDK3PDK4 | |
| SCHEMBL28719848 | 1.00 | SETD7 (0.47) | SETD7PDK1PDK2PDK3PDK4 | |
| SCHEMBL3395559 | 0.88 | SETD7 (0.47) | SETD7PDK1PDK2PDK3PDK4 | |
| SCHEMBL18701809 | 0.88 | SETD7 (0.49) | SETD7USP2SMN1; SMN2NR1H2MEN1 | |
| SCHEMBL4336794 | 0.86 | SETD7 (0.52) | SETD7USP2SMN1; SMN2NR1H2MEN1 | |
| SCHEMBL28055264 | 0.84 | SETD7 (0.51) | SETD7USP2SMN1; SMN2NR1H2MEN1 | |
| SCHEMBL28060463 | 0.83 | SETD7 (0.50) | SETD7USP2SMN1; SMN2NR1H2MEN1 | |
| SCHEMBL26666330 | 0.83 | SETD7 (0.50) | SETD7USP2SMN1; SMN2NR1H2MEN1 | |
| SCHEMBL17560369 | 0.83 | SETD7 (0.50) | SETD7USP2SMN1; SMN2NR1H2MEN1 | |
| SCHEMBL17560370 | 0.83 | SETD7 (0.50) | SETD7USP2SMN1; SMN2NR1H2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110088098-B | Quinazolinone PARP-1 inhibitor and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2022-04-15 | — | — | CN | disclosed |