Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAF1 | P04049 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.39 |
| ▸ | KDR | P35968 | 6/20 | 0.38 |
| ▸ | BRAF | P15056 | 2/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27423552 | 0.80 | SMN1; SMN2 (0.56) | RAF1MAPTMAPK1NPC1ALDH1A1 | |
| SCHEMBL5319900 | 0.79 | RAF1 (0.39) | RAF1MAPTMAPK1NPC1ALDH1A1 | |
| SCHEMBL20605406 | 0.77 | ALDH1A1 (0.45) | MAPTMAPK1NPC1ALDH1A1LMNA | |
| SCHEMBL15490439 | 0.75 | SMN1; SMN2 (0.41) | RAF1MAPTMAPK1NPC1ALDH1A1 | |
| SCHEMBL5032967 | 0.74 | CYP3A4 (0.44) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL22567997 | 0.73 | GAA (0.43) | MAPTMAPK1NPC1ALDH1A1LMNA | |
| SCHEMBL3180657 | 0.73 | RAF1 (0.50) | RAF1MAPTNPC1ALDH1A1LMNA | |
| SCHEMBL5317250 | 0.73 | ACHE (0.50) | MAPTMAPK1NPC1ALDH1A1LMNA | |
| SCHEMBL5316491 | 0.73 | MET (0.37) | MAPTLMNAHSP90AA1CHRM1TBXA2R | |
| SCHEMBL7131517 | 0.73 | CYP1A2 (0.40) | RAF1MAPTMAPK1NPC1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007079173-A2 | NOVEL 2-HETEROARYLOXY-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS | EMERGENT BIOSOLUTIONS INC. (US) | 2007-07-12 | — | — | WO | disclosed |