Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.34 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | SOS1 | Q07889 | 3/20 | 0.33 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30292599 | 1.00 | SMN1; SMN2 (0.39) | SMN1; SMN2ALDH1A1KDM4ENPC1TP53 | |
| SCHEMBL29278098 | 0.86 | SMN1; SMN2 (0.41) | SMN1; SMN2ALDH1A1KDM4ENPC1TP53 | |
| SCHEMBL28880435 | 0.85 | ALDH1A1 (0.38) | SMN1; SMN2ALDH1A1KDM4ENPC1TP53 | |
| SCHEMBL28880397 | 0.80 | NPC1 (0.35) | SMN1; SMN2ALDH1A1NPC1RAB9ALMNA | |
| SCHEMBL28880345 | 0.80 | L3MBTL1 (0.35) | SMN1; SMN2ALDH1A1LMNAL3MBTL1MAPK1 | |
| SCHEMBL28880344 | 0.80 | L3MBTL1 (0.35) | SMN1; SMN2ALDH1A1LMNAL3MBTL1MAPK1 | |
| SCHEMBL29163982 | 0.78 | TAS2R14 (0.39) | SMN1; SMN2LMNASOS1GAA | |
| SCHEMBL23563447 | 0.74 | TRPA1 (0.46) | AAK1CTSLCTSBCTSK | |
| SCHEMBL28880409 | 0.74 | TRPA1 (0.46) | AAK1CTSLCTSBCTSK | |
| SCHEMBL29945842 | 0.74 | TRPA1 (0.46) | AAK1CTSLCTSBCTSK |
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 |
|---|---|---|---|---|---|---|---|
| CN-117999263-A | SOS1 inhibitor with pyrido six-membered ring structure | 上海海和药物研究开发股份有限公司 | 2024-05-07 | — | — | CN | disclosed |
| CN-115135315-A | SOS1 inhibitors | 米拉蒂治疗股份有限公司 | 2022-09-30 | — | — | CN | disclosed |