Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | VHL | P40337 | 1/20 | 0.36 |
| ▸ | ELOC | Q15369 | 1/20 | 0.36 |
| ▸ | ELOB | Q15370 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 13/20 | 0.35 |
| ▸ | HTR2B | P41595 | 13/20 | 0.35 |
| ▸ | HTR2A | P28223 | 12/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TNF | P01375 | 1/20 | 0.33 |
| ▸ | IL6 | P05231 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30880421 | 1.00 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1VHLELOCELOB | |
| SCHEMBL24188888 | 0.75 | ALDH1A1 (0.44) | ALDH1A1L3MBTL1VHLELOCELOB | |
| SCHEMBL2156971 | 0.74 | KDM4E (0.39) | ALDH1A1VHLELOCELOBKDM4E | |
| SCHEMBL9404887 | 0.74 | VHL (0.39) | ALDH1A1VHLELOCELOBKDM4E | |
| SCHEMBL23861131 | 0.74 | MAOA (0.44) | ALDH1A1L3MBTL1VHLELOCELOB | |
| SCHEMBL8822554 | 0.74 | VHL (0.39) | ALDH1A1VHLELOCELOBKDM4E | |
| SCHEMBL8472833 | 0.74 | VHL (0.46) | ALDH1A1VHLELOCELOBKDM4E | |
| SCHEMBL3827464 | 0.72 | HTR2C (0.40) | HTR2CHTR2BHTR2ATNFIL6 | |
| SCHEMBL29515304 | 0.70 | ALDH1A1 (0.53) | ALDH1A1VHLELOCELOBKDM4E | |
| SCHEMBL29565791 | 0.69 | ALDH1A1 (0.42) | ALDH1A1L3MBTL1MAPT |
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-112939958-B | Condensed ring acyl compound and application thereof | 沈阳中化农药化工研发有限公司 | 2024-05-14 | — | — | CN | disclosed |