Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.42 |
| ▸ | RAB9A | P51151 | 7/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.40 |
| ▸ | HSP90B1 | P14625 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7995706 | 0.90 | HSP90AA1 (0.41) | NPC1RAB9ASMN1; SMN2HSP90AA1HSP90B1 | |
| SCHEMBL7984007 | 0.85 | HSP90AA1 (0.38) | HSP90AA1HSP90B1ALDH1A1LMNAMAPK1 | |
| SCHEMBL7997836 | 0.84 | TP53 (0.41) | KMT2ASMN1; SMN2MEN1HSP90AA1HSP90B1 | |
| SCHEMBL7994182 | 0.83 | KMT2A (0.40) | NPC1RAB9AKMT2ASMN1; SMN2L3MBTL1 | |
| SCHEMBL7996140 | 0.82 | KMT2A (0.39) | NPC1RAB9AKMT2ASMN1; SMN2L3MBTL1 | |
| SCHEMBL7995693 | 0.81 | KMT2A (0.38) | NPC1RAB9AKMT2ASMN1; SMN2L3MBTL1 | |
| SCHEMBL7995824 | 0.77 | SMN1; SMN2 (0.50) | NPC1RAB9AKMT2ASMN1; SMN2L3MBTL1 | |
| SCHEMBL7994645 | 0.76 | HSP90AA1 (0.34) | RAB9AHSP90AA1HSP90B1MAPTHTT | |
| SCHEMBL7998777 | 0.76 | GRM2 (0.45) | RAB9AKMT2AMEN1CYP1A2CYP2D6 | |
| SCHEMBL7998204 | 0.76 | GRM2 (0.41) | RAB9AKMT2ASMN1; SMN2MEN1CYP1A2 |
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-2001034578-A1 | COMPOUNDS WITH ANTI-HELICOBACTER PYLORI ACTIVITY | ASTRAZENECA AB (SE) | 2001-05-17 | — | — | WO | claimed |
| WO-2001034578-A1 | COMPOUNDS WITH ANTI-HELICOBACTER PYLORI ACTIVITY | ASTRAZENECA AB (SE) | 2001-05-17 | — | — | WO | disclosed |