Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | ANTXR2 | P58335 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 2/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | IL1B | P01584 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL28792328 | 1.00 | MAOA (0.37) | MAOATP53MAPTCYP3A4ANTXR2 | |
| SCHEMBL29876849 | 0.98 | MAOA (0.36) | MAOATP53MAPTCYP3A4ANTXR2 | |
| SCHEMBL28792261 | 0.79 | MGLL (0.33) | MAOACYP3A4KDM4EALDH1A1CYP1A2 | |
| SCHEMBL29678955 | 0.79 | MGLL (0.33) | MAOACYP3A4KDM4EALDH1A1CYP1A2 | |
| SCHEMBL29678743 | 0.79 | MAOB (0.34) | MAOACYP3A4PTPN1KDM4EALDH1A1 | |
| SCHEMBL28792357 | 0.79 | MAOB (0.34) | MAOACYP3A4PTPN1KDM4EALDH1A1 | |
| SCHEMBL28792388 | 0.77 | CYP3A4 (0.38) | MAOATP53MAPTCYP3A4ANTXR2 | |
| SCHEMBL31544919 | 0.69 | ACHE (0.50) | MAPTCYP3A4ALDH1A1IL1BP2RX1 | |
| SCHEMBL9902751 | 0.68 | CA12 (0.45) | TP53MAPTCYP3A4ANTXR2XDH | |
| SCHEMBL21866618 | 0.68 | ACHE (0.42) | IL1BP2RX1TMPRSS4CES2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114761410-B | Pyrrolopyrimidinone compounds and application thereof | 广州必贝特医药股份有限公司 | 2023-08-25 | — | — | CN | disclosed |
| WO-2022213932-A1 | PYRROLOPYRIMIDINONE COMPOUND AND APPLICATION THEREOF | 广州必贝特医药股份有限公司 | 2022-10-13 | — | — | WO | disclosed |
| CN-114761410-A | Pyrrolopyrimidinone compounds and application thereof | 广州必贝特医药股份有限公司 | 2022-07-15 | — | — | CN | disclosed |