Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | CCR4 | P51679 | 3/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27870867 | 0.84 | ALDH1A1 (0.35) | ALDH1A1F2GLAHPGDALOX5 | |
| SCHEMBL28797676 | 0.82 | GRM5 (0.36) | ALDH1A1F2GLAHPGDALOX5 | |
| SCHEMBL1135172 | 0.81 | KDM4E (0.34) | ALDH1A1F2GLAHPGDALOX5 | |
| SCHEMBL4944664 | 0.75 | KDM4E (0.39) | ALDH1A1F2GLAHPGDALOX5 | |
| SCHEMBL23093183 | 0.74 | CCR4 (0.40) | ALDH1A1CCR4 | |
| SCHEMBL30399474 | 0.71 | MEN1 (0.37) | ALDH1A1TDP1SIRT6MEN1KMT2A | |
| SCHEMBL14775168 | 0.71 | MEN1 (0.37) | ALDH1A1TDP1SIRT6MEN1KMT2A | |
| SCHEMBL4947714 | 0.70 | LMNA (0.50) | KDM4ECYP3A4ALOX12TDP1KMT2A | |
| SCHEMBL27696455 | 0.69 | SIRT6 (0.42) | ALDH1A1F2GLAHPGDKDM4E | |
| SCHEMBL27812288 | 0.69 | LMNA (0.33) | ALDH1A1F2GLAHPGDALOX5 |
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-105164121-A | Perfluorinated cyclopropyl-fused 1, 3-oxazin-2-amine compounds as beta-secretase inhibitors and methods of use thereof | AMGEN INC | 2015-12-16 | — | — | CN | disclosed |