Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 5/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7363061 | 0.79 | USP2 (0.50) | USP2CYP2D6CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL4749321 | 0.72 | USP2 (0.44) | USP2CYP2D6CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL4746204 | 0.72 | USP2 (0.44) | USP2CYP2D6CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL7368781 | 0.70 | USP2 (0.39) | USP2CYP2D6CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL7290614 | 0.69 | USP2 (0.45) | USP2CYP2D6CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL737635 | 0.68 | OPRM1 (0.61) | USP2CYP2D6CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL27600474 | 0.67 | CYP2C9 (0.36) | CYP2C9CYP2C19MEN1KMT2ASIGMAR1 | |
| Isopropylbenzene SCHEMBL29155850 | 0.67 | MEN1 (0.48) | USP2CYP2D6CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL7044504 | 0.67 | GRIN1 (0.39) | CYP1A2OPRM1MEN1KMT2ANPSR1 | |
| Hydrochloric Acid SCHEMBL10007993 | 0.67 | OPRM1 (0.59) | USP2CYP2D6CYP2C9CYP1A2CYP3A4 |
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-2008124582-A1 | RENIN INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-10-16 | — | — | WO | disclosed |