Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.77 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.77 |
| ▸ | HPGD | P15428 | 2/20 | 0.77 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.77 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.66 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.66 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.66 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.66 |
| ▸ | CA12 | O43570 | 2/20 | 0.54 |
| ▸ | CA1 | P00915 | 2/20 | 0.54 |
| ▸ | CA2 | P00918 | 2/20 | 0.54 |
| ▸ | CA7 | P43166 | 2/20 | 0.54 |
| ▸ | CA9 | Q16790 | 2/20 | 0.54 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.54 |
| ▸ | CA3 | P07451 | 1/20 | 0.54 |
| ▸ | CA4 | P22748 | 1/20 | 0.54 |
| ▸ | CA6 | P23280 | 1/20 | 0.54 |
| ▸ | CA5A | P35218 | 1/20 | 0.54 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.54 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8206713 | 1.00 | ALDH1A1 (0.77) | ALDH1A1KDM4EHPGDHSD17B10GRIN2D | |
| SCHEMBL29353299 | 0.87 | ALDH1A1 (1.00) | ALDH1A1KDM4EHPGDHSD17B10GRIN2D | |
| SCHEMBL551105 | 0.87 | ALDH1A1 (1.00) | ALDH1A1KDM4EHPGDHSD17B10GRIN2D | |
| SCHEMBL17137307 | 0.86 | KDM4E (0.57) | ALDH1A1KDM4EHPGDHSD17B10GRIN2D | |
| SCHEMBL17136965 | 0.86 | ALDH1A1 (0.57) | ALDH1A1KDM4EHPGDHSD17B10GRIN2D | |
| SCHEMBL24488059 | 0.86 | KDM4E (0.57) | ALDH1A1KDM4EHPGDHSD17B10GRIN2D | |
| SCHEMBL27354312 | 0.84 | GRIN2D (0.66) | ALDH1A1KDM4EHPGDHSD17B10GRIN2D | |
| SCHEMBL8501456 | 0.81 | KDM4E (0.52) | ALDH1A1KDM4EHPGDHSD17B10GRIN2D | |
| SCHEMBL10353592 | 0.81 | GRIN2D (0.82) | ALDH1A1KDM4EHPGDHSD17B10GRIN2D | |
| SCHEMBL8207252 | 0.81 | KDM4E (0.77) | ALDH1A1KDM4EHPGDHSD17B10GRIN2D |
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 |
|---|---|---|---|---|---|---|---|
| US-20220177446-A1 | ALKYNE COMPOUNDS AS IRAK INHIBITORS, PREPARATION METHODS AND MEDICINAL USES THEREOF | Eternity Bioscience Inc. | 2022-06-09 | — | — | 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-20220177446-A1 | ALKYNE COMPOUNDS AS IRAK INHIBITORS, PREPARATION METHODS AND MEDICINAL USES THEREOF | IRAK2, IRAK3, IRAK4 | ALDH1A1 2365/4885KDM4E 178/4885HPGD 4023/4885 |
“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.