Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5332752 | 0.84 | TP53 (0.48) | CYP2C9CYP2C19CYP1A2GAAALDH1A1 | |
| SCHEMBL5322483 | 0.82 | NAMPT (0.43) | CYP2C9CYP2C19CYP1A2GAANAMPT | |
| SCHEMBL5321672 | 0.82 | MAPK1 (0.47) | CYP2C9CYP2C19CYP1A2GAANAMPT | |
| SCHEMBL5322490 | 0.80 | GPR142 (0.46) | ALDH1A1NAMPTLMNA | |
| SCHEMBL3210271 | 0.79 | L3MBTL1 (0.44) | CYP2C9CYP2C19CYP1A2GAANAMPT | |
| SCHEMBL4428749 | 0.78 | ALDH1A1 (0.60) | CYP2C9CYP2C19CYP1A2ALDH1A1MAPT | |
| SCHEMBL5359415 | 0.78 | HPGD (0.56) | ALDH1A1NAMPTMAPTTSHR | |
| SCHEMBL31692132 | 0.76 | TSHR (0.47) | ALDH1A1MAPTLMNATSHR | |
| SCHEMBL4431573 | 0.76 | MEN1 (0.57) | CYP2C9CYP2C19ALDH1A1MAPTLMNA | |
| SCHEMBL5328948 | 0.73 | ALDH1A1 (0.63) | CYP2C9CYP2C19CYP1A2GAAALDH1A1 |
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-2007135427-A1 | 1,4-DISUBSTITUTED PIPERAZINE AND 1,4-DISUBSTITUTED AZEPANE AS 11 -BETA-HYDROXYSTEROID DEHYDROGENASE 1 INHIBITORS | ASTRAZENECA AB (SE) | 2007-11-29 | — | — | WO | claimed |
| WO-2007135427-A1 | 1,4-DISUBSTITUTED PIPERAZINE AND 1,4-DISUBSTITUTED AZEPANE AS 11 -BETA-HYDROXYSTEROID DEHYDROGENASE 1 INHIBITORS | ASTRAZENECA AB (SE) | 2007-11-29 | — | — | WO | disclosed |