Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.69 |
| ▸ | HPGD | P15428 | 4/20 | 0.69 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.69 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.69 |
| ▸ | MEN1 | O00255 | 2/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.69 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.69 |
| ▸ | POLB | P06746 | 1/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.69 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.69 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.69 |
| ▸ | RELA | Q04206 | 1/20 | 0.69 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.67 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29637242 | 1.00 | ALDH1A1 (0.69) | ALDH1A1KDM4EHPGDCYP1A2CYP2C19 | |
| SCHEMBL9764625 | 1.00 | ALDH1A1 (0.69) | ALDH1A1KDM4EHPGDCYP1A2CYP2C19 | |
| SCHEMBL28249968 | 0.82 | KDM4E (0.69) | ALDH1A1KDM4EHPGDCYP1A2CYP2C19 | |
| SCHEMBL28249969 | 0.82 | KDM4E (0.69) | ALDH1A1KDM4EHPGDCYP1A2CYP2C19 | |
| SCHEMBL29637246 | 0.82 | KDM4E (0.69) | ALDH1A1KDM4EHPGDCYP1A2CYP2C19 | |
| SCHEMBL11275577 | 0.81 | KDM4E (1.00) | ALDH1A1KDM4EHPGDCYP1A2CYP2C19 | |
| SCHEMBL11268973 | 0.81 | KDM4E (1.00) | ALDH1A1KDM4EHPGDCYP1A2CYP2C19 | |
| SCHEMBL214423 | 0.81 | KDM4E (1.00) | ALDH1A1KDM4EHPGDCYP1A2CYP2C19 | |
| SCHEMBL29637244 | 0.81 | KDM4E (1.00) | ALDH1A1KDM4EHPGDCYP1A2CYP2C19 | |
| SCHEMBL5433929 | 0.81 | KDM4E (1.00) | ALDH1A1KDM4EHPGDCYP1A2CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5066633-A | Sensitizer for heat sensitive paper coatings | GRAPHIC CONTROLS CORPORATION (US) | 1991-11-19 | — | — | US | claimed |
| CN-108752300-B | Benzylidene phenylene peptide compound, pharmaceutical composition and application thereof | 中国科学院昆明植物研究所 | 2022-03-25 | — | — | CN | disclosed |
| CN-108752300-A | Benzyl alkene pitches benzene peptides and its pharmaceutical composition and its application | 中国科学院昆明植物研究所 | 2018-11-06 | — | — | CN | disclosed |
| US-5066633-A | Sensitizer for heat sensitive paper coatings | GRAPHIC CONTROLS CORPORATION (US) | 1991-11-19 | — | — | US | disclosed |