Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | GRM5 | P41594 | 2/20 | 0.56 |
| ▸ | MGLL | Q99685 | 1/20 | 0.52 |
| ▸ | SFRP1 | Q8N474 | 2/20 | 0.51 |
| ▸ | PRKAA2 | P54646 | 3/20 | 0.49 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.49 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.49 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.49 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.49 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.49 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.49 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.48 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6824304 | 0.86 | ALDH1A1 (0.57) | ALDH1A1KDM4EPOLBHPGDALOX15 | |
| SCHEMBL6821107 | 0.80 | ALDH1A1 (0.67) | ALDH1A1KDM4EPOLBHPGDALOX15 | |
| SCHEMBL6825336 | 0.80 | ALDH1A1 (0.57) | ALDH1A1KDM4EPOLBHPGDALOX15 | |
| SCHEMBL6821089 | 0.80 | ALDH1A1 (0.58) | ALDH1A1KDM4EPOLBHPGDALOX15 | |
| SCHEMBL6824130 | 0.79 | ALDH1A1 (0.69) | ALDH1A1KDM4EPOLBHPGDALOX15 | |
| SCHEMBL6139577 | 0.78 | ALDH1A1 (0.68) | ALDH1A1KDM4EPOLBHPGDALOX15 | |
| SCHEMBL7288482 | 0.76 | EPHX1 (0.69) | ALDH1A1HPGDL3MBTL1 | |
| SCHEMBL13648899 | 0.76 | ALDH1A1 (0.64) | ALDH1A1KDM4EPOLBHPGDALOX15 | |
| SCHEMBL6139979 | 0.75 | ALDH1A1 (0.55) | ALDH1A1KDM4EPOLBHPGDALOX15 | |
| Trifluoroacetic Acid SCHEMBL6824444 | 0.75 | ALDH1A1 (0.57) | ALDH1A1KDM4EPOLBHPGDALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004074278-A1 | NOVEL COMPOUNDS | ASTRAZENECA AB (SE) | 2004-09-02 | — | — | WO | disclosed |