Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.38 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.38 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.38 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.33 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | ANPEP | P15144 | 4/20 | 0.32 |
| ▸ | LAP3 | P28838 | 4/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1743244 | 0.80 | — | — | |
| SCHEMBL12268172 | 0.79 | TSHR (0.42) | SLC7A5CACNA2D1CACNB3CACNA1CPGR | |
| SCHEMBL22703033 | 0.79 | — | — | |
| SCHEMBL8636238 | 0.79 | TSHR (0.42) | SLC7A5CACNA2D1CACNB3CACNA1CPGR | |
| Hydrochloric Acid SCHEMBL28201851 | 0.78 | SLC7A5 (0.35) | SLC7A5CACNA2D1CACNB3CACNA1CPGR | |
| Hydrochloric Acid SCHEMBL11128017 | 0.76 | MMP1 (0.43) | SLC7A5CACNA2D1CACNB3CACNA1CPGR | |
| SCHEMBL8217960 | 0.76 | MGAM (0.46) | ALDH1A1TDP1TSHR | |
| SCHEMBL5396840 | 0.75 | ANPEP (0.39) | SLC7A5CACNA2D1CACNB3CACNA1CPGR | |
| SCHEMBL15698690 | 0.75 | CACNA2D1 (0.41) | SLC7A5CACNA2D1CACNB3CACNA1CPGR | |
| SCHEMBL12297016 | 0.74 | CYP2D6 (0.45) | TDP1MMP1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3154930-A1 | METHOD FOR THE PREPARATION OF BETA-SUBSTITUTED GAMMA-AMINO CARBOXYLIC ACIDS | Siegfried Ltd. (CH) | 2017-04-19 | — | — | EP | disclosed |
| WO-2015189068-A1 | METHOD FOR THE PREPARATION OF BETA-SUBSTITUTED GAMMA-AMINO CARBOXYLIC ACIDS | SIEGFRIED LTD. (CH) | 2015-12-17 | — | — | WO | disclosed |