Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 5/20 | 0.59 |
| ▸ | MAOB | P27338 | 5/20 | 0.59 |
| ▸ | PRKCI | P41743 | 1/20 | 0.59 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.53 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.53 |
| ▸ | BRD4 | O60885 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | GRM5 | P41594 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1090221 | 1.00 | MAOA (0.59) | MAOAMAOBPRKCIHSD17B1BAZ2B | |
| SCHEMBL1091518 | 0.89 | CASP1 (0.56) | MAOAMAOBPRKCIHSD17B1GRM5 | |
| SCHEMBL10436091 | 0.86 | MAOA (0.59) | MAOAMAOBPRKCIHSD17B1BAZ2B | |
| SCHEMBL30853867 | 0.86 | BRD4 (0.48) | MAOAMAOBPRKCIHSD17B1BAZ2B | |
| SCHEMBL27485186 | 0.86 | BRD4 (0.48) | MAOAMAOBPRKCIHSD17B1BAZ2B | |
| SCHEMBL29546005 | 0.84 | ALDH1A1 (0.65) | MAOAMAOBPRKCIHSD17B1BAZ2B | |
| SCHEMBL356493 | 0.84 | ALDH1A1 (0.65) | MAOAMAOBPRKCIHSD17B1BAZ2B | |
| SCHEMBL390556 | 0.84 | PARP10 (0.53) | MAOAMAOBPRKCIHSD17B1BAZ2B | |
| SCHEMBL9944562 | 0.83 | MAOA (0.59) | MAOAMAOBPRKCIHSD17B1BAZ2B | |
| SCHEMBL10193085 | 0.83 | BAZ2B (0.65) | MAOAMAOBPRKCIHSD17B1BAZ2B |
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-113660932-B | Phenyl derivatives having pendant alkyl and alkenyl extensions and pharmaceutical compositions comprising the same | 景凯生物科技股份有限公司 | 2024-07-12 | — | — | CN | disclosed |
| CN-114149457-B | Benzo [ c ] [1,2] oxaborole-1 (3H) -alcohol compound and application thereof | 湖北民族大学 | 2024-04-12 | — | — | CN | disclosed |