Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 1/20 | 0.45 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PTGES2 | Q9H7Z7 | 3/20 | 0.38 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL13469116 | 0.88 | ALDH1A1 (0.50) | NR3C1TSHRALDH1A1POLBPTGES2 | |
| SCHEMBL3715386 | 0.81 | PLA2G7 (0.54) | NR3C1PLA2G7TSHRALDH1A1POLB | |
| SCHEMBL3557136 | 0.79 | SLC16A3 (0.48) | NR3C1 | |
| SCHEMBL27183132 | 0.78 | TSHR (0.44) | PLA2G7TSHRALDH1A1POLBPSIP1 | |
| SCHEMBL10438570 | 0.77 | ALDH1A1 (0.57) | TSHRALDH1A1POLBL3MBTL1SMN1; SMN2 | |
| SCHEMBL3555506 | 0.76 | SLC16A3 (0.60) | NR3C1TSHRALDH1A1POLBL3MBTL1 | |
| SCHEMBL3559060 | 0.73 | SLC16A3 (0.64) | NR3C1 | |
| SCHEMBL13468525 | 0.73 | ALDH1A1 (0.50) | NR3C1TSHRALDH1A1POLBL3MBTL1 | |
| SCHEMBL13689141 | 0.73 | ADRA2B (0.42) | TSHRALDH1A1POLBL3MBTL1ADRA2B | |
| SCHEMBL14131238 | 0.72 | PSIP1 (0.51) | NR3C1TSHRALDH1A1POLBPTGES2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3216786-A1 | PYRIMIDINE OR PYRIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF | Shanghai Shaletech Technology Co., Ltd. (CN) | 2017-09-13 | — | — | EP | disclosed |