Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SSTR4 | P31391 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | G6PD | P11413 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31068646 | 0.77 | MAPT (0.41) | PTGS2ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL27305156 | 0.75 | LRRK2 (0.36) | PTGS2ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL13424282 | 0.75 | SSTR4 (0.45) | SSTR4SCN9ACNR2HCRTR1HCRTR2 | |
| SCHEMBL12777847 | 0.74 | CLK2 (0.33) | SSTR4ALDH1A1MAPTKDM4E | |
| SCHEMBL2490706 | 0.73 | HPGD (0.45) | SSTR4ALDH1A1MEN1KMT2AL3MBTL1 | |
| SCHEMBL30852201 | 0.72 | ALDH1A1 (0.34) | SSTR4PTGS2ALDH1A1MAPTMEN1 | |
| SCHEMBL27314157 | 0.72 | ADORA2A (0.35) | ALDH1A1MAPTMEN1KMT2AL3MBTL1 | |
| SCHEMBL30851767 | 0.72 | ADORA2A (0.35) | ALDH1A1MAPTMEN1KMT2AL3MBTL1 | |
| SCHEMBL22259414 | 0.72 | ADORA2A (0.39) | PTGS2ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL5218807 | 0.71 | NPC1 (0.45) | ALDH1A1MAPTMEN1KMT2AL3MBTL1 |
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-104520296-B | Pyrrolopyridinone derivatives as TTX-S blocker | 拉夸里亚创药株式会社 | 2016-11-16 | — | — | CN | disclosed |