Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17594174 | 0.80 | THRB (0.51) | CYP1A2CYP2C9CYP2C19MAPK1HIF1A | |
| SCHEMBL8722927 | 0.79 | ALDH1A1 (0.39) | CYP1A2CYP2C9CYP2C19MAPK1HIF1A | |
| SCHEMBL4931565 | 0.75 | LMNA (0.58) | ALDH1A1MAPTSMN1; SMN2MAOBKMT2A | |
| SCHEMBL5143592 | 0.74 | TDP1 (0.57) | CYP1A2CYP2C9CYP2C19MAPK1HIF1A | |
| SCHEMBL43967 | 0.73 | HCAR2 (0.59) | CYP1A2CYP2C9CYP2C19NPSR1MAPK1 | |
| SCHEMBL161364 | 0.73 | ALDH1A1 (0.50) | ALDH1A1MAPTSMN1; SMN2TDP1MAOA | |
| SCHEMBL6081328 | 0.73 | CYP1A2 (0.49) | CYP1A2CYP2C9CYP2C19NPSR1MAPK1 | |
| SCHEMBL6081322 | 0.73 | CYP1A2 (0.49) | CYP1A2CYP2C9CYP2C19NPSR1MAPK1 | |
| SCHEMBL28551317 | 0.71 | CYP1A2 (0.58) | CYP1A2CYP2C9CYP2C19NPSR1MAPK1 | |
| Toluene SCHEMBL4328611 | 0.71 | CYP1A2 (0.46) | CYP1A2CYP2C9CYP2C19NPSR1MAPK1 |
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-1992000972-A1 | RENIN INHIBITING COMPOUNDS | ABBOTT LABORATORIES (US) | 1992-01-23 | — | — | WO | disclosed |