Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TYK2 | P29597 | 2/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | JAK1 | P23458 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | BCR | P11274 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.37 |
| ▸ | PTPRC | P08575 | 1/20 | 0.37 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | PTPRA | P18433 | 1/20 | 0.37 |
| ▸ | PTPRB | P23467 | 1/20 | 0.37 |
| ▸ | PTPRE | P23469 | 1/20 | 0.37 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7127279 | 0.83 | MAP2K1 (0.41) | ALDH1A1SMN1; SMN2TYK2JAK2JAK1 | |
| SCHEMBL305505 | 0.81 | ALDH1A1 (0.63) | ALDH1A1TP53SMN1; SMN2ANO1LMNA | |
| SCHEMBL31364369 | 0.81 | ALDH1A1 (0.63) | ALDH1A1TP53SMN1; SMN2ANO1LMNA | |
| SCHEMBL1934879 | 0.81 | ALDH1A1 (0.42) | ALDH1A1TP53ANO1LMNATYK2 | |
| SCHEMBL21592065 | 0.80 | PTPRC (0.40) | ALDH1A1SMN1; SMN2POLBNLRP3PTPRC | |
| SCHEMBL27994220 | 0.79 | ALDH1A1 (0.61) | ALDH1A1TP53SMN1; SMN2ANO1LMNA | |
| SCHEMBL1786179 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TP53ANO1LMNAABL1 | |
| SCHEMBL1180410 | 0.79 | MEN1 (0.53) | ALDH1A1TP53SMN1; SMN2LMNAABL1 | |
| SCHEMBL24195885 | 0.78 | PTPRC (0.39) | ALDH1A1SMN1; SMN2POLBNLRP3PTPRC | |
| SCHEMBL363918 | 0.78 | ALDH1A1 (0.65) | ALDH1A1TP53SMN1; SMN2LMNATYK2 |
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-2020063760-A1 | NOVEL HETEROCYCLIC DERIVATIVES USEFUL AS SHP2 INHIBITORS | JACOBIO PHARMACEUTICALS CO., LTD. (CN) | 2020-04-02 | — | — | WO | disclosed |