Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MGAT2 | Q10469 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.35 |
| ▸ | CPT1A | P50416 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 3/20 | 0.33 |
| ▸ | MMP9 | P14780 | 3/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 2/20 | 0.33 |
| ▸ | MMP13 | P45452 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1802571 | 0.93 | HSD17B10 (0.42) | HSD17B10MGAT2CYP19A1ALOX12SMN1; SMN2 | |
| SCHEMBL1802401 | 0.83 | HSD17B10 (0.42) | HSD17B10MGAT2CYP19A1ALDH1A1L3MBTL1 | |
| SCHEMBL4803750 | 0.77 | KDM4E (0.40) | ALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL1802875 | 0.75 | HSD17B10 (0.42) | HSD17B10CYP19A1SMN1; SMN2 | |
| SCHEMBL7684037 | 0.74 | SMN1; SMN2 (0.33) | SMN1; SMN2 | |
| SCHEMBL1802898 | 0.71 | SMN1; SMN2 (0.36) | HSD17B10SMN1; SMN2NPSR1 | |
| SCHEMBL9147062 | 0.70 | MAPT (0.36) | HSD17B10CYP19A1CPT1AMMP2MMP9 | |
| SCHEMBL38953 | 0.70 | SMN1; SMN2 (0.56) | ALDH1A1MEN1KMT2ASMN1; SMN2NPSR1 | |
| SCHEMBL20712625 | 0.69 | SMN1; SMN2 (0.30) | SMN1; SMN2 | |
| SCHEMBL1069797 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011052759-A1 | NOVEL NITROXYL RADICAL COMPOUND AND PROCESS FOR PRODUCTION THEREOF | 国立大学法人九州大学 (JP) | 2011-05-05 | — | — | WO | disclosed |