Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.37 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.37 |
| ▸ | JAK3 | P52333 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | PREP | P48147 | 2/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.31 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.31 |
| ▸ | CYP4A11 | Q02928 | 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 | |
|---|---|---|---|---|
| SCHEMBL28389036 | 0.95 | GRIN2B (0.40) | CTSKGRIN2BGRIN2CJAK3HPGD | |
| SCHEMBL28389038 | 0.95 | GRIN2B (0.40) | CTSKGRIN2BGRIN2CJAK3HPGD | |
| SCHEMBL5469923 | 0.82 | — | — | |
| SCHEMBL5473755 | 0.82 | — | — | |
| SCHEMBL24999579 | 0.81 | CTSK (0.37) | CTSKGRIN2BGRIN2CJAK3HPGD | |
| SCHEMBL20399337 | 0.80 | CTSK (0.39) | CTSKGRIN2BGRIN2CJAK3HPGD | |
| SCHEMBL21530334 | 0.80 | CTSK (0.39) | CTSKGRIN2BGRIN2CJAK3HPGD | |
| SCHEMBL21530335 | 0.80 | CTSK (0.39) | CTSKGRIN2BGRIN2CJAK3HPGD | |
| SCHEMBL4247705 | 0.80 | JAK3 (0.39) | CTSKGRIN2BGRIN2CJAK3HPGD | |
| SCHEMBL1025678 | 0.77 | — | — |
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-106928126-B | Amide derivative, preparation method and pharmaceutical application thereof | 四川海思科制药有限公司 | 2019-12-20 | — | — | CN | disclosed |