Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.38 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.37 |
| ▸ | ADH1B | P00325 | 1/20 | 0.36 |
| ▸ | ADH1C | P00326 | 1/20 | 0.36 |
| ▸ | ADH1A | P07327 | 1/20 | 0.36 |
| ▸ | ADH4 | P08319 | 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 | |
|---|---|---|---|---|
| SCHEMBL16765831 | 0.97 | ALDH1A1 (0.40) | ALDH1A1HSD17B10EPHX1SMN1; SMN2CYP3A4 | |
| SCHEMBL3393818 | 0.78 | PDK1 (0.48) | ALDH1A1HSD17B10EPHX1SMN1; SMN2CYP3A4 | |
| SCHEMBL183427 | 0.78 | PDK1 (0.44) | ALDH1A1HSD17B10EPHX1SMN1; SMN2CYP3A4 | |
| SCHEMBL1153020 | 0.78 | PDK1 (0.44) | ALDH1A1HSD17B10EPHX1SMN1; SMN2CYP3A4 | |
| SCHEMBL28292813 | 0.74 | PDK1 (0.41) | ALDH1A1HSD17B10EPHX1SMN1; SMN2CYP3A4 | |
| SCHEMBL1725786 | 0.73 | ALDH1A1 (0.47) | ALDH1A1HSD17B10EPHX1SMN1; SMN2CYP3A4 | |
| SCHEMBL19144522 | 0.72 | EPHX1 (0.36) | ALDH1A1HSD17B10EPHX1SMN1; SMN2CYP3A4 | |
| SCHEMBL12570881 | 0.71 | MMP2 (0.45) | ALDH1A1HSD17B10EPHX1SMN1; SMN2CYP3A4 | |
| SCHEMBL7778173 | 0.71 | ALDH1A1 (0.45) | ALDH1A1HSD17B10EPHX1SMN1; SMN2CYP3A4 | |
| SCHEMBL50080 | 0.71 | ALDH1A1 (0.45) | ALDH1A1HSD17B10EPHX1SMN1; SMN2CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7276484-B2 | Dipeptide inhibitors of β-secretase | ELAN PHARMACEUTICALS, INC. (US) | 2007-10-02 | — | — | US | disclosed |
| US-20050182138-A1 | Dipeptide inhibitors of beta-secretase | ELAN PHARMACEUTICALS, INC. | 2005-08-18 | — | — | US | disclosed |
| US-6864240-B1 | Dipeptide inhibitors of β-secretase | ELAN PHARMACEUTICALS, INC. (US) | 2005-03-08 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20050182138-A1 | Dipeptide inhibitors of beta-secretase | BACE1, APP, BACE2 | ALDH1A1 3256/4885HSD17B10 2493/4885EPHX1 1638/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.