Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 8/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | CASP6 | P55212 | 1/20 | 0.32 |
| ▸ | ELAVL1 | Q15717 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL348533 | 0.82 | ADAMTS4 (0.38) | EPHX2CYP2D6MEN1KMT2AALDH1A1 | |
| SCHEMBL30278562 | 0.80 | ALDH1A1 (0.36) | MEN1KMT2AALDH1A1L3MBTL1GAA | |
| SCHEMBL31544811 | 0.80 | ALDH1A1 (0.36) | MEN1KMT2AALDH1A1L3MBTL1GAA | |
| SCHEMBL6417418 | 0.79 | AKR1C3 (0.36) | EPHX2CYP2D6MEN1KMT2AALDH1A1 | |
| SCHEMBL9485617 | 0.79 | PIK3CG (0.32) | EPHX2CYP2D6MEN1KMT2AALDH1A1 | |
| SCHEMBL3389669 | 0.79 | EPHX2 (0.40) | MCOLN3EPHX2MEN1KMT2AGAA | |
| SCHEMBL20573229 | 0.79 | EPHX2 (0.38) | MCOLN3EPHX2CYP2D6MEN1KMT2A | |
| SCHEMBL5802385 | 0.78 | EPHX2 (0.42) | MCOLN3EPHX2MEN1KMT2AGAA | |
| SCHEMBL30439756 | 0.78 | ALDH1A1 (0.35) | MEN1KMT2AALDH1A1L3MBTL1GAA | |
| SCHEMBL20485 | 0.78 | ALDH1A1 (0.35) | MEN1KMT2AALDH1A1L3MBTL1GAA |
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-113248435-B | 3-Formamido-4-hydroxy sodium Qu Tongdao generation derivative, preparation method and medical application thereof | 上海翰森生物医药科技有限公司 | 2024-06-04 | — | — | CN | disclosed |
| CN-113248435-A | 3-formamido-4-hydroxy naltrexone deuterated derivatives, preparation method thereof and application thereof in medicines | 上海翰森生物医药科技有限公司 | 2021-08-13 | — | — | CN | disclosed |