Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | REN | P00797 | 8/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | NOS2 | P35228 | 2/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 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 | |
|---|---|---|---|---|
| SCHEMBL499264 | 0.96 | REN (0.39) | RENCYP3A4AOC3KDM4ES1PR3 | |
| SCHEMBL498921 | 0.96 | REN (0.39) | RENCYP3A4AOC3KDM4ES1PR3 | |
| SCHEMBL498922 | 0.86 | SLC6A4 (0.52) | SLC6A4RENCYP3A4NOS2MEN1 | |
| SCHEMBL499203 | 0.86 | SLC6A4 (0.52) | SLC6A4RENCYP3A4NOS2MEN1 | |
| SCHEMBL4756782 | 0.85 | IDO1 (0.37) | RENNOS2KDM4EMEN1MAPT | |
| SCHEMBL499224 | 0.81 | AOC3 (0.40) | AOC3KDM4EGPR88IDO1AURKA | |
| SCHEMBL499588 | 0.80 | IDO1 (0.39) | RENKDM4EMEN1MAPTHTT | |
| SCHEMBL499136 | 0.80 | REN (0.49) | RENCYP3A4 | |
| SCHEMBL499685 | 0.80 | REN (0.49) | RENCYP3A4 | |
| SCHEMBL4754002 | 0.77 | SLC6A4 (0.56) | SLC6A4CYP3A4NOS2CYP1A2TSHR |
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-2008156816-A2 | RENIN INHIBITORS | VITAE PHARMACEUTICALS, INC. (US) | 2008-12-24 | — | — | WO | disclosed |