Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 5/20 | 0.39 |
| ▸ | THRB | P10828 | 5/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.31 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4276128 | 0.74 | DAO (0.34) | PARP1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL4420770 | 0.73 | POLB (0.35) | PARP1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL26008693 | 0.73 | HCAR2 (0.37) | THRATHRBALDH1A1DYRK1ANPC1 | |
| SCHEMBL15633292 | 0.69 | MAPK1 (0.59) | PARP1L3MBTL1GAANPC1RAB9A | |
| SCHEMBL27725624 | 0.68 | HPGD (0.43) | ALDH1A1KDM4EGAAPDE3BPDE3A | |
| SCHEMBL20743794 | 0.67 | — | — | |
| SCHEMBL30991131 | 0.67 | HCAR2 (0.52) | DAOHCAR2 | |
| SCHEMBL27906349 | 0.67 | ALDH1A1 (0.50) | ALDH1A1GAANPC1RAB9A | |
| SCHEMBL27784137 | 0.67 | GLA (0.40) | ALDH1A1KDM4EGLAGAAGRIN2D | |
| SCHEMBL20606968 | 0.66 | MAP2K1 (0.37) | THRATHRBKDM4ENPC1RAB9A |
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-2004096804-A1 | DIAZABICYCLONONENE AND TETRAHYDROPYRIDINE DERIVATIVES AS RENIN INHIBITORS | ACTELION PHARMACEUTICALS LTD (CH) | 2004-11-11 | — | — | WO | disclosed |