Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.43 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.43 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.43 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.43 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.43 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.43 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.43 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.43 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.42 |
| ▸ | BTK | Q06187 | 1/20 | 0.41 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.40 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.40 |
| ▸ | METAP2 | P50579 | 1/20 | 0.40 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL9565348 | 0.83 | SMN1; SMN2 (0.50) | SMN1; SMN2PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL7435148 | 0.77 | PDGFRB (0.49) | CYP2A6ALKKDM5BMETAP2SIRT3 | |
| SCHEMBL9565355 | 0.73 | ALDH1A1 (0.49) | SMN1; SMN2CYP2A6DYRK1AALDH1A1CYP1A2 | |
| SCHEMBL9464649 | 0.72 | NR1H2 (0.47) | SMN1; SMN2PRMT5WDR77KDM5BCYP1A2 | |
| SCHEMBL1435798 | 0.70 | SMN1; SMN2 (0.63) | SMN1; SMN2PRKAA1CYP2A6BTKALK | |
| SCHEMBL9565323 | 0.70 | HSD17B10 (0.45) | SMN1; SMN2CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL11598851 | 0.69 | SMN1; SMN2 (0.87) | SMN1; SMN2CYP2A6BTKALDH1A1CYP1A2 | |
| SCHEMBL7440831 | 0.68 | CYP2A6 (0.44) | CYP2A6ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL831106 | 0.67 | SMN1; SMN2 (0.63) | SMN1; SMN2CYP2A6BTKMETAP2SIRT3 | |
| SCHEMBL4873033 | 0.67 | SMN1; SMN2 (0.63) | SMN1; SMN2CYP2A6BTKALKMETAP2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0543245-A1 | Renin inhibiting amino acid derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1993-05-26 | — | — | EP | disclosed |