Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | HCAR1 | Q9BXC0 | 2/20 | 0.39 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.39 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7600132 | 0.81 | L3MBTL1 (0.60) | PARP1SMN1; SMN2TP53ALDH1A1L3MBTL1 | |
| SCHEMBL29607244 | 0.81 | L3MBTL1 (0.60) | PARP1SMN1; SMN2TP53ALDH1A1L3MBTL1 | |
| SCHEMBL3751890 | 0.79 | CHEK1 (0.51) | ALDH1A1 | |
| SCHEMBL25975808 | 0.79 | PARP1 (0.47) | PARP1SMN1; SMN2TP53POLBTRPA1 | |
| SCHEMBL3755039 | 0.79 | PARP1 (0.51) | PARP1L3MBTL1KDM4E | |
| SCHEMBL12049203 | 0.77 | TP53 (0.53) | PARP1SMN1; SMN2TP53TRPA1ALDH1A1 | |
| SCHEMBL10084695 | 0.74 | TP53 (0.51) | SMN1; SMN2TP53POLBTRPA1ALDH1A1 | |
| SCHEMBL31103600 | 0.74 | FGFR1 (0.59) | SMN1; SMN2TP53POLBHCAR1 | |
| SCHEMBL30743619 | 0.74 | KDM4E (0.54) | SMN1; SMN2POLBALDH1A1L3MBTL1KDM4E | |
| SCHEMBL19911336 | 0.74 | FGFR1 (0.42) | PARP1SMN1; SMN2ALDH1A1HCAR1 |
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-113880806-B | 2-amino-4-oxo-quinazoline dithiocarbamate derivative, and pharmaceutical composition and application thereof | 深圳大学 | 2022-09-13 | — | — | CN | disclosed |
| CN-113880806-A | 2-amino-4-oxo-quinazoline dithio formate derivative, and pharmaceutical composition and application thereof | 深圳大学 | 2022-01-04 | — | — | CN | disclosed |
| WO-2021242923-A1 | TLR2 MODULATOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | AXIAL THERAPEUTICS, INC. (US) | 2021-12-02 | — | — | WO | disclosed |