Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.35 |
| ▸ | SOS2 | Q07890 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | FLT1 | P17948 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24399680 | 1.00 | ALDH1A1 (0.38) | ALDH1A1POLBTSHRKMT2ANR4A2 | |
| SCHEMBL25375809 | 0.82 | AR (0.41) | ALDH1A1HTTMAPTKCNH2MPO | |
| SCHEMBL25377855 | 0.81 | S1PR4 (0.38) | ALDH1A1POLBTSHRKMT2APDE10A | |
| SCHEMBL24399590 | 0.79 | FLT1 (0.38) | ALDH1A1POLBPDE10AFLT1KDR | |
| SCHEMBL30402640 | 0.79 | FLT1 (0.38) | ALDH1A1POLBPDE10AFLT1KDR | |
| SCHEMBL30401932 | 0.78 | MPO (0.40) | KMT2ANR4A2SMN1; SMN2GAAMAPT | |
| SCHEMBL25376705 | 0.78 | MPO (0.40) | KMT2ANR4A2SMN1; SMN2GAAMAPT | |
| SCHEMBL30401336 | 0.78 | CSNK2A2 (0.41) | HTTFLT1KDRGAAMPO | |
| SCHEMBL25374531 | 0.78 | CSNK2A2 (0.41) | HTTFLT1KDRGAAMPO | |
| SCHEMBL24399674 | 0.77 | AR (0.41) | ALDH1A1KMT2ASMN1; SMN2GAACYP1A2 |
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-116096718-A | Aryl amide compound, pharmaceutical composition containing same, preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2023-05-09 | — | — | CN | disclosed |