Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.44 |
| ▸ | XIAP | P98170 | 2/20 | 0.38 |
| ▸ | BIRC2 | Q13490 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 4/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | PLEC | Q15149 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | TDO2 | P48775 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9109997 | 0.74 | NOS1 (0.38) | ALDH1A1MAPTGAAHPGDKDM4E | |
| SCHEMBL9108518 | 0.66 | GSK3B (0.49) | ALDH1A1MAPTGAAHPGDKDM4E | |
| SCHEMBL9109613 | 0.66 | GSK3B (0.49) | ALDH1A1MAPTGAAHPGDKDM4E | |
| SCHEMBL9109620 | 0.66 | GSK3B (0.49) | ALDH1A1MAPTGAAHPGDKDM4E | |
| SCHEMBL1559670 | 0.63 | ALDH1A1 (0.45) | ALDH1A1MAPTGAAHPGDAGTR1 | |
| SCHEMBL2361451 | 0.63 | KDM4E (0.57) | ALDH1A1MAPTGAAHPGDKDM4E | |
| SCHEMBL17854806 | 0.61 | XIAP (0.55) | ALDH1A1MAPTGAAXIAPBIRC2 | |
| SCHEMBL31038410 | 0.60 | ALDH1A1 (0.53) | ALDH1A1MAPTGAALMNAMEN1 | |
| SCHEMBL1458967 | 0.60 | ALDH1A1 (0.53) | ALDH1A1MAPTGAALMNAMEN1 | |
| SCHEMBL31738422 | 0.59 | TDP1 (0.66) | ALDH1A1MAPTGAAHPGDKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-8207169-B2 | Substituted [1,2,4]triazolo[4′,3′:1,6]pyrido[2,3-b]pyrazines of the formula D | MSD K.K. (JP) | 2012-06-26 | — | — | US | disclosed |
| US-20110092511-A1 | INHIBITORS OF AKT ACTIVITY | MERCK SHARP & DOHME LLC | 2011-04-21 | — | — | 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-20110092511-A1 | INHIBITORS OF AKT ACTIVITY | AKT1S1, AKT1, PIK3CA | ALDH1A1 4132/4885MAPT 4425/4885GAA 1275/4885 |
“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.