Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | MPO | P05164 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2004792 | 0.84 | ALDH1A1 (0.73) | ALDH1A1KDM4EMPOCYP1A2CYP3A4 | |
| SCHEMBL23019950 | 0.82 | HDAC6 (0.55) | ALDH1A1KDM4ETP53HTTL3MBTL1 | |
| SCHEMBL12209203 | 0.82 | TP53 (0.53) | ALDH1A1KDM4EMPOCYP1A2CYP3A4 | |
| SCHEMBL16785428 | 0.82 | ALDH1A1 (0.76) | ALDH1A1KDM4EMPOCYP1A2CYP3A4 | |
| SCHEMBL23019918 | 0.81 | PLK1 (0.60) | KMT2AHDAC1 | |
| SCHEMBL23019839 | 0.81 | HDAC3 (0.43) | ALDH1A1KDM4EMPOCYP1A2CYP3A4 | |
| SCHEMBL24746825 | 0.79 | HTT (0.43) | ALDH1A1KDM4EMPOCYP1A2CYP3A4 | |
| SCHEMBL15647152 | 0.79 | CYP3A4 (0.43) | ALDH1A1KDM4EMPOCYP1A2CYP3A4 | |
| SCHEMBL3069331 | 0.78 | ALDH1A1 (0.55) | ALDH1A1KDM4ECYP1A2GAATP53 | |
| SCHEMBL1694694 | 0.78 | ALDH1A1 (0.64) | ALDH1A1KDM4EMPOCYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2900666-B1 | AZAQUINAZOLINE INHIBITORS OF ATYPICAL PROTEIN KINASE C | CANCER RESEARCH TECH LTD (GB) | 2020-11-04 | — | — | EP | disclosed |
| WO-2014052699-A9 | AZAQUINAZOLINE INHIBITORS OF ATYPICAL PROTEIN KINASE C | IGNYTA, INC. (US) | 2015-07-16 | — | — | WO | disclosed |