Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TNF | P01375 | 1/20 | 0.41 |
| ▸ | ATR | Q13535 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30578899 | 0.81 | GABRA1 (0.51) | MAPTMAPK1GABRA1GABRG2GABRB3 | |
| SCHEMBL87573 | 0.81 | GABRA1 (0.51) | MAPTMAPK1GABRA1GABRG2GABRB3 | |
| SCHEMBL28877297 | 0.75 | TNF (0.41) | ALDH1A1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL30730878 | 0.74 | KDM4E (0.49) | ALDH1A1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL1321259 | 0.74 | KDM4E (0.49) | ALDH1A1MAPTKDM4EHPGDSMN1; SMN2 | |
| Biphenyl SCHEMBL1073325 | 0.73 | ALDH1A1 (0.55) | ALDH1A1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL27267419 | 0.73 | CA12 (0.45) | ALDH1A1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL2228819 | 0.73 | SMN1; SMN2 (0.47) | ALDH1A1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL30632058 | 0.73 | SMN1; SMN2 (0.47) | ALDH1A1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL13078934 | 0.72 | ALDH1A1 (0.45) | ALDH1A1MAPTKDM4EHPGDSMN1; SMN2 |
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-109535032-B | Poly-p-phenylethene derivative containing naphthalene ring structure and cyano group and preparation method and application thereof | 黑龙江大学 | 2021-06-25 | — | — | CN | claimed |
| CN-109535032-B | Poly-p-phenylethene derivative containing naphthalene ring structure and cyano group and preparation method and application thereof | 黑龙江大学 | 2021-06-25 | — | — | CN | disclosed |