Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.48 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.48 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11412912 | 1.00 | SMN1; SMN2 (0.57) | SMN1; SMN2NPC1RAB9AMAPTMAPK1 | |
| SCHEMBL20827027 | 0.98 | SMN1; SMN2 (0.54) | SMN1; SMN2NPC1RAB9AMAPTMAPK1 | |
| SCHEMBL24485231 | 0.94 | MAPT (0.48) | SMN1; SMN2NPC1RAB9AMAPTMAPK1 | |
| SCHEMBL15294792 | 0.90 | EGLN1 (0.47) | SMN1; SMN2NPC1RAB9AMAPTMAPK1 | |
| SCHEMBL11518690 | 0.84 | EPHX1 (0.51) | SMN1; SMN2NPC1RAB9AMAPTMAPK1 | |
| SCHEMBL18459805 | 0.83 | ALDH1A1 (0.48) | SMN1; SMN2NPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL6989749 | 0.82 | EPHX1 (0.50) | NPC1RAB9AMAPTMAPK1ALDH1A1 | |
| SCHEMBL23207493 | 0.82 | EPHX2 (0.41) | SMN1; SMN2NPC1RAB9AMAPTMAPK1 | |
| SCHEMBL2802318 | 0.81 | EPHX1 (0.60) | SMN1; SMN2NPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL20350198 | 0.81 | EPHX1 (0.60) | SMN1; SMN2NPC1RAB9AMAPTALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113754604-B | Nitrogen-containing chiral ligand and application thereof in asymmetric oxidation reaction of thioether | 江苏奥赛康药业有限公司 | 2023-09-08 | — | — | CN | disclosed |
| CN-113754604-A | Nitrogen-containing chiral ligand and application thereof in asymmetric oxidation reaction of thioether | 江苏奥赛康药业有限公司 | 2021-12-07 | — | — | CN | disclosed |
| US-5021081-A | Herbicidal substituted triazoles | BAYER AKTIENGESELLSCHAFT (DE) | 1991-06-04 | — | — | US | disclosed |