Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | BACE1 | P56817 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| SCHEMBL8808180 | 0.82 | HSD17B10 (0.41) | MGLLHSD17B10ALDH1A1POLBMAPT | |
| SCHEMBL8204221 | 0.82 | ALOX5 (0.43) | FAAHMGLLALDH1A1BACE1POLB | |
| SCHEMBL8811652 | 0.82 | HSD17B10 (0.58) | HSD17B10ALDH1A1BACE1USP2CYP2D6 | |
| Hydrochloric Acid SCHEMBL8809755 | 0.81 | HSD17B10 (0.40) | MGLLHSD17B10ALDH1A1MAPTMCHR1 | |
| SCHEMBL592180 | 0.78 | ALDH1A1 (0.37) | FAAHMGLLHSD17B10ALDH1A1BACE1 | |
| SCHEMBL8209542 | 0.77 | BACE1 (0.67) | BACE1CYP2D6MCHR1OPRM1OPRD1 | |
| SCHEMBL30436420 | 0.77 | BACE1 (0.43) | FAAHMGLLALDH1A1BACE1POLB | |
| SCHEMBL25258942 | 0.75 | AR (0.55) | FAAHMGLLALDH1A1POLBGAA | |
| SCHEMBL30381901 | 0.75 | AR (0.55) | FAAHMGLLALDH1A1POLBGAA | |
| Trifluoroacetic Acid SCHEMBL4252943 | 0.75 | ALOX5 (0.38) | ALDH1A1BACE1USP2CYP2D6ALOX5 |
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-2008030412-A2 | SPIROPIPERIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | MERCK & CO., INC. (US) | 2008-03-13 | — | — | WO | disclosed |