Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 11/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4188909 | 1.00 | NLRP3 (0.59) | NLRP3ALDH1A1CYP1A2HDAC4MEN1 | |
| SCHEMBL2885788 | 0.86 | NLRP3 (0.64) | NLRP3ALDH1A1CYP1A2HDAC4MAPT | |
| SCHEMBL4602459 | 0.86 | NLRP3 (0.62) | NLRP3ALDH1A1CYP1A2MEN1KMT2A | |
| SCHEMBL30675594 | 0.86 | NLRP3 (0.62) | NLRP3ALDH1A1CYP1A2MEN1KMT2A | |
| SCHEMBL439465 | 0.86 | HDAC4 (0.71) | NLRP3ALDH1A1CYP1A2HDAC4MEN1 | |
| SCHEMBL441932 | 0.86 | HDAC4 (0.67) | NLRP3ALDH1A1CYP1A2HDAC4MEN1 | |
| SCHEMBL13233238 | 0.84 | HDAC4 (0.65) | NLRP3ALDH1A1CYP1A2HDAC4MEN1 | |
| SCHEMBL7093999 | 0.84 | ALDH1A1 (0.58) | NLRP3ALDH1A1CYP1A2HDAC4MEN1 | |
| SCHEMBL5142374 | 0.83 | ALDH1A1 (0.66) | NLRP3ALDH1A1CYP1A2HDAC4MEN1 | |
| SCHEMBL11014261 | 0.83 | L3MBTL1 (0.67) | NLRP3ALDH1A1CYP1A2HDAC4MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112745262-B | Preparation method of brexpiprazole intermediate 7-hydroxy-1H-quinoline-2-ketone | 江苏恩华药业股份有限公司 | 2022-07-12 | — | — | CN | disclosed |