Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.37 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | METAP1 | P53582 | 1/20 | 0.36 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.35 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.35 |
| ▸ | PRKCI | P41743 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.30 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19785099 | 0.79 | KDM4E (0.39) | KDM4EALDH1A1LMNATDP1LRRK2 | |
| SCHEMBL28576286 | 0.78 | KDM4E (0.41) | KDM4EALDH1A1LMNATDP1LRRK2 | |
| SCHEMBL30897222 | 0.78 | KDM4E (0.38) | KDM4EALDH1A1LMNATDP1LRRK2 | |
| SCHEMBL29211872 | 0.78 | KDM4E (0.38) | KDM4EALDH1A1LMNATDP1LRRK2 | |
| SCHEMBL29006810 | 0.77 | CSNK2A1 (0.35) | KDM4EALDH1A1LMNATDP1LRRK2 | |
| SCHEMBL21921077 | 0.77 | KDM4E (0.40) | KDM4EALDH1A1LMNATDP1LRRK2 | |
| SCHEMBL21575418 | 0.75 | CSNK2A1 (0.35) | KDM4EALDH1A1LMNATDP1LRRK2 | |
| SCHEMBL22440558 | 0.75 | KDM4E (0.39) | KDM4EALDH1A1LMNATDP1LRRK2 | |
| SCHEMBL22440534 | 0.73 | KDM4E (0.38) | KDM4EALDH1A1LMNATDP1LRRK2 | |
| SCHEMBL31288549 | 0.73 | KDM4E (0.38) | KDM4EALDH1A1LMNATDP1LRRK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024175081-A1 | SHP2 INHIBITOR COMPOUND AND USE THEREOF | 深圳真实生物医药科技有限公司 | 2024-08-29 | — | — | WO | disclosed |
| WO-2018013597-A1 | 2,5-DISUBSTITUTED 3-METHYL PYRAZINES AND 2,5,6-TRISUBSTITUTED 3-METHYL PYRAZINES AS ALLOSTERIC SHP2 INHIBITORS | Revolution Medicines, Inc. (US) | 2018-01-18 | — | — | WO | disclosed |