Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | CTSB | P07858 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.32 |
| ▸ | CTSH | P09668 | 1/20 | 0.32 |
| ▸ | S100A4 | P26447 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL25378118 | 1.00 | ALDH1A1 (0.46) | ALDH1A1TSHRTDP1MEN1KMT2A | |
| SCHEMBL25376047 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRTDP1MEN1KMT2A | |
| SCHEMBL30401809 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRTDP1MEN1KMT2A | |
| SCHEMBL25376149 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TSHRTDP1MEN1KMT2A | |
| SCHEMBL2260806 | 0.76 | ALDH1A1 (0.50) | ALDH1A1TSHRTDP1MEN1KMT2A | |
| SCHEMBL30162663 | 0.76 | ALDH1A1 (0.50) | ALDH1A1TSHRTDP1MEN1KMT2A | |
| SCHEMBL17263930 | 0.76 | TSHR (0.64) | ALDH1A1TSHRTDP1MEN1KMT2A | |
| SCHEMBL25376257 | 0.75 | ALDH1A1 (0.47) | ALDH1A1TSHRTDP1MEN1KMT2A | |
| SCHEMBL30402540 | 0.75 | ALDH1A1 (0.47) | ALDH1A1TSHRTDP1MEN1KMT2A | |
| SCHEMBL6603021 | 0.74 | ALDH1A1 (0.48) | ALDH1A1TSHRTDP1MEN1KMT2A |
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 |