Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28702630 | 0.85 | HTT (0.42) | MAPK1LMNAMAPTTDP1KMT2A | |
| SCHEMBL28932719 | 0.77 | CA12 (0.40) | LMNAKMT2ASMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL20855345 | 0.74 | USP2 (0.41) | MAPTMEN1KMT2AKDM4EL3MBTL1 | |
| SCHEMBL20855351 | 0.74 | RAB9A (0.45) | LMNAMAPTMEN1KMT2AALDH1A1 | |
| SCHEMBL28545419 | 0.74 | ALDH1A1 (0.34) | MAPTKMT2AALDH1A1GAA | |
| SCHEMBL28679901 | 0.74 | PTGS1 (0.33) | — | |
| SCHEMBL22911700 | 0.73 | — | — | |
| SCHEMBL5281859 | 0.72 | MEN1 (0.49) | MAPK1MAPTTDP1MEN1KMT2A | |
| SCHEMBL3381832 | 0.71 | — | — | |
| SCHEMBL22911702 | 0.70 | POLB (0.33) | — |
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-113929637-B | Sulfur-containing dihydro isoxazole compound and synthetic method thereof | 山东大学 | 2024-02-06 | — | — | CN | disclosed |
| CN-113929637-A | Sulfur-containing dihydro isoxazole compound and synthetic method thereof | 山东大学 | 2022-01-14 | — | — | CN | disclosed |