Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29940874 | 1.00 | MAOA (0.44) | MAOACYP3A4SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL20439174 | 0.85 | HIF1A (0.44) | CYP3A4SMN1; SMN2ALDH1A1HSD17B10HIF1A | |
| SCHEMBL28906146 | 0.72 | KDM4E (0.48) | MAOACYP3A4SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL6439681 | 0.72 | MAOA (0.48) | MAOACYP3A4SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL29940757 | 0.72 | KDM4E (0.48) | MAOACYP3A4SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL29940739 | 0.71 | FAAH (0.46) | MAOACYP3A4SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL28906154 | 0.71 | FAAH (0.46) | MAOACYP3A4SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL5202274 | 0.70 | ESR1 (0.50) | MAOACYP3A4SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL16927398 | 0.69 | NR4A2 (0.46) | MAOACYP3A4SMN1; SMN2KDM4EALDH1A1 | |
| Xanthone SCHEMBL27708184 | 0.69 | MAOA (0.82) | MAOACYP3A4SMN1; SMN2KDM4EALDH1A1 |
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-115109006-A | 3-substituted-1, 2-benzoxazine-4-ketone compound and preparation method thereof | 上海大学 | 2022-09-27 | — | — | CN | disclosed |