Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.60 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | CA2 | P00918 | 4/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL22299941 | 0.85 | PTGS2 (0.64) | PTGS2PTGS1ALDH1A1CA2CA12 | |
| SCHEMBL12633723 | 0.84 | ALDH1A1 (0.74) | PTGS2PTGS1ALDH1A1CA2CA12 | |
| SCHEMBL20186922 | 0.84 | ALDH1A1 (0.74) | PTGS2PTGS1ALDH1A1CA2CA12 | |
| SCHEMBL255410 | 0.84 | ALDH1A1 (0.74) | PTGS2PTGS1ALDH1A1CA2CA12 | |
| SCHEMBL11557679 | 0.84 | ALDH1A1 (0.74) | PTGS2PTGS1ALDH1A1CA2CA12 | |
| SCHEMBL11588746 | 0.84 | ALDH1A1 (0.74) | PTGS2PTGS1ALDH1A1CA2CA12 | |
| SCHEMBL27622892 | 0.84 | CA2 (0.64) | PTGS2PTGS1ALDH1A1CA2CA12 | |
| SCHEMBL7793269 | 0.83 | NPC1 (0.68) | PTGS2PTGS1ALDH1A1MAPTCYP1A1 | |
| SCHEMBL7793264 | 0.83 | NPC1 (0.68) | PTGS2PTGS1ALDH1A1MAPTCYP1A1 | |
| SCHEMBL11409007 | 0.81 | PTGS2 (0.59) | PTGS2PTGS1ALDH1A1CA2CA12 |
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-115745808-B | Method for preparing secondary amine compound by catalyzing reduction of imine compound | 延安大学 | 2024-04-30 | — | — | CN | disclosed |
| CN-115745808-A | Method for preparing secondary amine compound by catalyzing reduction of imine compound | 延安大学 | 2023-03-07 | — | — | CN | disclosed |