Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.32 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.32 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.31 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL2631496 | 0.97 | — | — | |
| SCHEMBL125061 | 0.97 | — | — | |
| SCHEMBL5541229 | 0.97 | — | — | |
| SCHEMBL28065510 | 0.94 | TP53 (0.42) | TP53SLC7A5ALDH1A1MAPTPTGS1 | |
| Propene SCHEMBL27932304 | 0.84 | TP53 (0.35) | TP53SLC7A5ALDH1A1MAPTPTGS1 | |
| SCHEMBL28425398 | 0.82 | TP53 (0.33) | TP53SLC7A5ALDH1A1MAPTPTGS1 | |
| SCHEMBL12691439 | 0.80 | — | — | |
| SCHEMBL17407606 | 0.79 | ALDH1A1 (0.40) | TP53SLC7A5ALDH1A1MAPTPTGS1 | |
| SCHEMBL10804484 | 0.78 | TP53 (0.44) | TP53SLC7A5ALDH1A1MAPTPTGS1 | |
| SCHEMBL8848440 | 0.78 | TP53 (0.44) | TP53SLC7A5ALDH1A1MAPTPTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103068807-B | By using the preparation method of phenyl substituted heterocycle derivative of coupling process of palladium compound | TEIJIN PHARMA LTD. (JP) | 2016-05-25 | — | — | CN | disclosed |