Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | ACMSD | Q8TDX5 | 4/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | BCR | P11274 | 1/20 | 0.34 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.34 |
| ▸ | BCL2 | P10415 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 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 | |
|---|---|---|---|---|
| SCHEMBL19104720 | 0.87 | GABRA1 (0.48) | APPCYP1A2GABRA1GABRB2HSD17B1 | |
| SCHEMBL1257364 | 0.84 | GABRA1 (0.52) | APPCYP1A2GABRA1GABRB2HSD17B1 | |
| SCHEMBL5558364 | 0.83 | CYP1A2 (0.55) | APPCYP1A2GABRA1GABRB2ACMSD | |
| SCHEMBL5932002 | 0.77 | AGXT (0.47) | BCL2GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL12247921 | 0.76 | HSD17B1 (0.46) | CYP1A2GABRA1GABRB2HSD17B1ESR1 | |
| SCHEMBL10437334 | 0.75 | PTPN5 (0.43) | GABRA1GABRB2MMP3AKR1B1 | |
| SCHEMBL20684735 | 0.74 | ADRB2 (0.36) | CYP1A2GABRA1GABRB2 | |
| SCHEMBL20262937 | 0.73 | SLC7A5 (0.39) | GRIN2DGRIN3BGRIN1GRIN2AGRIN2B | |
| SCHEMBL239755 | 0.71 | ESR1 (0.48) | GABRA1GABRB2BACE1MEN1ESR1 | |
| SCHEMBL16581416 | 0.70 | HSD17B1 (0.62) | APPCYP1A2GABRA1GABRB2ACMSD |
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-3190107-B1 | ARYL COMPOUND SUBSTITUTED WITH GLYCIDYL AND ALLYL GROUPS AS MACROMONOMER FOR HEAT RESISTANT RESIN MATERIALS | SHINETSU CHEMICAL CO (JP) | 2019-01-30 | — | — | EP | disclosed |