Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.57 |
| ▸ | MAPT | P10636 | 6/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.57 |
| ▸ | LMNA | P02545 | 4/20 | 0.57 |
| ▸ | CASP1 | P29466 | 4/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | THRB | P10828 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.39 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10915016 | 0.83 | KDM4E (0.59) | ALDH1A1MAPTKDM4ELMNACASP1 | |
| SCHEMBL5270640 | 0.78 | HSD17B10 (0.48) | ALDH1A1KDM4ELMNATSHRGAA | |
| SCHEMBL29827105 | 0.78 | HSD17B10 (0.48) | ALDH1A1KDM4ELMNATSHRGAA | |
| SCHEMBL3313274 | 0.78 | ALDH1A1 (0.55) | ALDH1A1MAPTKDM4ELMNACASP1 | |
| SCHEMBL23251399 | 0.75 | MPI (0.41) | ALDH1A1MAPTKDM4ELMNASMN1; SMN2 | |
| SCHEMBL10813949 | 0.75 | CYP1A2 (0.39) | ALDH1A1MAPTKDM4ELMNACASP1 | |
| SCHEMBL11044012 | 0.75 | ACHE (0.45) | ALDH1A1KDM4ELMNATSHRGAA | |
| SCHEMBL10915888 | 0.75 | LMNA (0.50) | ALDH1A1MAPTKDM4ELMNACASP1 | |
| SCHEMBL28422987 | 0.75 | KDM4E (0.50) | ALDH1A1MAPTKDM4ELMNACASP1 | |
| SCHEMBL10914973 | 0.75 | KDM4E (0.50) | ALDH1A1MAPTKDM4ELMNASMN1; 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-107531645-A | The inhibitor of gangrenosum acne apoptosis | 催化剂治疗私人有限公司 | 2018-01-02 | — | — | CN | disclosed |
| US-4617316-A | Insecticidal heteroaryl substituted phenyl benzoylureas | FMC CORPORATION (US) | 1986-10-14 | — | — | US | disclosed |