Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.46 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.46 |
| ▸ | PTPN6 | P29350 | 2/20 | 0.46 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.46 |
| ▸ | PTPRF | P10586 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 3/20 | 0.45 |
| ▸ | KCNB1 | Q14721 | 5/20 | 0.42 |
| ▸ | ESRRA | P11474 | 1/20 | 0.42 |
| ▸ | KCNA5 | P22460 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28411155 | 0.88 | HPGD (0.52) | TDP1SMN1; SMN2HPGDNPSR1RXFP1 | |
| SCHEMBL28408420 | 0.81 | KCNB1 (0.60) | TDP1ALDH1A1HTTSMN1; SMN2PTPN1 | |
| SCHEMBL20412265 | 0.80 | EGFR (0.44) | ALDH1A1SMN1; SMN2HPGDL3MBTL1EGFR | |
| SCHEMBL18392377 | 0.80 | EGFR (0.60) | PTPN11EGFRKMT2ANOX4 | |
| SCHEMBL29793620 | 0.79 | SMN1; SMN2 (0.55) | TDP1ALDH1A1HTTSMN1; SMN2PTPN1 | |
| SCHEMBL15921537 | 0.75 | HTT (0.57) | TDP1ALDH1A1HTTSMN1; SMN2NPSR1 | |
| SCHEMBL5334070 | 0.75 | ALDH1A1 (0.57) | TDP1ALDH1A1HTTSMN1; SMN2HPGD | |
| SCHEMBL15177303 | 0.75 | ALDH1A1 (0.68) | TDP1ALDH1A1HTTSMN1; SMN2HPGD | |
| SCHEMBL28404799 | 0.74 | TAS1R3 (0.54) | TDP1ALDH1A1HTTSMN1; SMN2CREBBP | |
| SCHEMBL24074336 | 0.74 | ALDH1A1 (0.56) | TDP1ALDH1A1HTTSMN1; SMN2HPGD |
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-108929263-B | Arylamide Kv2.1 inhibitor and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2022-07-22 | — | — | CN | disclosed |
| CN-111108092-A | Arylamide Kv2.1 inhibitor and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2020-05-05 | — | — | CN | disclosed |