Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BPTF | Q12830 | 1/20 | 0.51 |
| ▸ | DKK1 | O94907 | 1/20 | 0.37 |
| ▸ | AKT2 | P31751 | 3/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | NCF1 | P14598 | 1/20 | 0.35 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.34 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.34 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.34 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.34 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.34 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 4/20 | 0.33 |
| ▸ | HTR2C | P28335 | 4/20 | 0.33 |
| ▸ | HTR2B | P41595 | 3/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.32 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20973033 | 0.78 | ALDH1A1 (0.37) | ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL20973017 | 0.78 | ALDH1A1 (0.41) | ALDH1A1 | |
| SCHEMBL20973036 | 0.76 | F2RL1 (0.37) | BPTFALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL20973043 | 0.76 | F2RL1 (0.37) | BPTFALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL3904650 | 0.73 | RAB9A (0.41) | ALDH1A1 | |
| SCHEMBL20973078 | 0.73 | HTT (0.43) | BPTFALDH1A1 | |
| SCHEMBL8274739 | 0.72 | ALDH1A1 (0.59) | BPTFAKT2GSK3BALDH1A1 | |
| SCHEMBL3301450 | 0.71 | BPTF (0.54) | BPTFALDH1A1 | |
| SCHEMBL28440354 | 0.71 | FAAH (0.40) | ALDH1A1 | |
| SCHEMBL8224135 | 0.71 | BPTF (0.50) | BPTFDKK1AKT2GSK3BNCF1 |
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-117820199-A | Amide compound and application thereof in preparation of Sigma2 and 5HT2A inhibitors | 瀚远医药有限公司 | 2024-04-05 | — | — | CN | disclosed |