Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8736767 | 0.85 | MEN1 (0.43) | MEN1KMT2ARAB9ANPSR1SMN1; SMN2 | |
| SCHEMBL29216450 | 0.82 | L3MBTL1 (0.41) | MEN1KMT2ANPSR1L3MBTL1ALDH1A1 | |
| SCHEMBL15020426 | 0.81 | SMN1; SMN2 (0.38) | MEN1KMT2ARAB9ANPSR1SMN1; SMN2 | |
| SCHEMBL3780747 | 0.80 | MEN1 (0.40) | MEN1KMT2ARAB9ANPSR1SMN1; SMN2 | |
| SCHEMBL6182625 | 0.80 | CRHBP (0.41) | MEN1KMT2ARAB9ANPSR1SMN1; SMN2 | |
| SCHEMBL31211554 | 0.79 | MEN1 (0.40) | MEN1KMT2ARAB9ANPSR1SMN1; SMN2 | |
| SCHEMBL31211555 | 0.79 | MEN1 (0.40) | MEN1KMT2ARAB9ANPSR1SMN1; SMN2 | |
| SCHEMBL29216482 | 0.78 | SMN1; SMN2 (0.46) | MEN1KMT2ASMN1; SMN2CYP3A4CYP2C9 | |
| SCHEMBL25984799 | 0.78 | ALDH1A1 (0.42) | MEN1KMT2ARAB9ANPSR1SMN1; SMN2 | |
| SCHEMBL5961039 | 0.77 | SLC7A5 (0.47) | L3MBTL1ATM |
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-117865773-A | Preparation method of difluoromethyl aromatic compound based on palladium-catalyzed decarbonylation coupling | 大连理工大学 | 2024-04-12 | — | — | CN | claimed |
| CN-117865773-A | Preparation method of difluoromethyl aromatic compound based on palladium-catalyzed decarbonylation coupling | 大连理工大学 | 2024-04-12 | — | — | CN | disclosed |