Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 3/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.45 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.43 |
| ▸ | PPARD | Q03181 | 2/20 | 0.40 |
| ▸ | KIF11 | P52732 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL955509 | 0.89 | CYP1A1 (0.46) | ERN1CYP1A1CYP1B1PPARDALDH1A1 | |
| SCHEMBL23226778 | 0.86 | PSEN1 (0.39) | PSEN1ALOX5PPARDKIF11ALDH1A1 | |
| SCHEMBL23226562 | 0.85 | MAOB (0.40) | PSEN1ALOX5KIF11ALDH1A1MAPT | |
| SCHEMBL23226619 | 0.85 | PSEN1 (0.40) | PSEN1ALOX5PPARDKIF11ALDH1A1 | |
| SCHEMBL23226546 | 0.85 | CACNA1B (0.41) | PSEN1ALOX5KIF11KDM4EMCHR1 | |
| SCHEMBL953869 | 0.82 | PTGDR2 (0.48) | CYP1A1CYP1B1PSEN1ALOX5PPARD | |
| SCHEMBL7943031 | 0.78 | ERN1 (0.49) | ERN1ALDH1A1MAPTHPGDHTT | |
| SCHEMBL957465 | 0.77 | CYP2C19 (0.50) | CYP1A1CYP1B1ALDH1A1MAPTHPGD | |
| SCHEMBL23226899 | 0.77 | EPHX2 (0.53) | KDM4E | |
| SCHEMBL7946267 | 0.77 | PPARD (0.41) | CYP1A1CYP1B1PSEN1ALOX5PPARD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010015653-A1 | PYRIMIDINE DERIVATIVES AS ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE | SMITHKLINE BEECHAM CORPORATION (US) | 2010-02-11 | — | — | WO | disclosed |
| WO-2009071504-A1 | 2,6-DISUBSTITUTED PYRIDINES AS SOLUBLE GUANYLATE CYCLASE ACTIVATORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-06-11 | — | — | WO | disclosed |