Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 1/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | TYR | P14679 | 1/20 | 0.35 |
| ▸ | USP7 | Q93009 | 1/20 | 0.34 |
| ▸ | TOP2A | P11388 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 2/20 | 0.32 |
| ▸ | VCP | P55072 | 2/20 | 0.32 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3394338 | 0.80 | AR (0.41) | ADORA2AADORA1GLAPOLBGAA | |
| SCHEMBL3396593 | 0.80 | KDM4E (0.45) | ADORA2AADORA1GLAGAATSHR | |
| SCHEMBL3128136 | 0.79 | ATR (0.48) | ADORA2AADORA1ATRALOX5APFEN1 | |
| SCHEMBL13425829 | 0.76 | ADORA2A (0.39) | ADORA2AADORA1GLAPOLBGAA | |
| SCHEMBL6234055 | 0.72 | ESR2 (0.43) | HSD17B1HSD17B2ESR2GLAPOLB | |
| SCHEMBL31256038 | 0.72 | GLA (0.54) | HSD17B1HSD17B2ESR2GLAPOLB | |
| SCHEMBL5792355 | 0.72 | GLA (0.54) | HSD17B1HSD17B2ESR2GLAPOLB | |
| SCHEMBL3530116 | 0.70 | ADORA2A (0.68) | ESR2ADORA2AADORA1POLBGAA | |
| SCHEMBL15948360 | 0.69 | KDM4E (0.39) | ADORA2AADORA1ATRALOX5APFEN1 | |
| SCHEMBL29131925 | 0.68 | HSD17B1 (0.48) | HSD17B1HSD17B2ESR2GLAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |
| WO-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |