Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 2/20 | 0.39 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | C1R | P00736 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.36 |
| ▸ | NPFFR1 | Q9GZQ6 | 2/20 | 0.35 |
| ▸ | NPFFR2 | Q9Y5X5 | 2/20 | 0.35 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | KMO | O15229 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15428680 | 0.76 | DPP4 (0.42) | NOTUMPSMB8HSD11B1C1RSCN9A | |
| SCHEMBL27860631 | 0.75 | ALDH1A1 (0.46) | NOTUMPSMB8C1RGPBAR1L3MBTL1 | |
| SCHEMBL28186243 | 0.74 | EIF4E (0.38) | NOTUMPSMB8HSD11B1C1RSCN9A | |
| SCHEMBL15428678 | 0.74 | PARP1 (0.47) | NOTUMPSMB8SCN9AGPBAR1SLC9A1 | |
| SCHEMBL28186237 | 0.73 | ALDH1A1 (0.46) | C1RL3MBTL1ALDH1A1HPGD | |
| SCHEMBL28186259 | 0.72 | MEN1 (0.39) | NOTUMGPBAR1 | |
| SCHEMBL28154899 | 0.72 | TRPA1 (0.45) | NOTUMPSMB8HSD11B1SCN9A | |
| SCHEMBL28185545 | 0.71 | NOTUM (0.42) | NOTUMMAOBGPBAR1KMOALDH1A1 | |
| SCHEMBL11957890 | 0.68 | GRIN2D (0.44) | PSMB8L3MBTL1ALDH1A1HPGD | |
| SCHEMBL197671 | 0.65 | HSD11B1 (0.56) | NOTUMPSMB8HSD11B1L3MBTL1ALDH1A1 |
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-107382892-A | A kind of preparation technology of the nitro isoxazole compound of 3 aryl 4 | 贵州大学 | 2017-11-24 | — | — | CN | disclosed |