Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.46 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.46 |
| ▸ | ABAT | P80404 | 1/20 | 0.46 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.46 |
| ▸ | FDPS | P14324 | 1/20 | 0.43 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.42 |
| ▸ | TUBB1 | Q9H4B7 | 3/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11594562 | 0.88 | ALDH1A1 (0.57) | ALDH1A1TSHRTDP1HPGDTRIM24 | |
| SCHEMBL493981 | 0.85 | SRC (0.45) | ALDH1A1TSHRTDP1HPGDTRIM24 | |
| SCHEMBL29411737 | 0.82 | ALDH1A1 (0.52) | ALDH1A1TSHRTDP1HPGDTRIM24 | |
| SCHEMBL5200065 | 0.82 | ALDH1A1 (0.52) | ALDH1A1TSHRTDP1HPGDTRIM24 | |
| SCHEMBL111326 | 0.80 | ALDH1A1 (0.53) | ALDH1A1TSHRTDP1HPGDTRIM24 | |
| SCHEMBL5045913 | 0.78 | ALDH1A1 (0.52) | ALDH1A1TSHRTDP1HPGDTRIM24 | |
| SCHEMBL973079 | 0.77 | ALDH1A1 (0.59) | ALDH1A1TSHRTDP1HPGDTRIM24 | |
| SCHEMBL5476629 | 0.77 | EGFR (0.58) | ALDH1A1TSHRTDP1HPGDTRIM24 | |
| SCHEMBL29952164 | 0.77 | EGFR (0.58) | ALDH1A1TSHRTDP1HPGDTRIM24 | |
| SCHEMBL13512685 | 0.77 | ALDH1A1 (0.50) | ALDH1A1TSHRTDP1HPGDTRIM24 |
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-20050065171-A1 | Substituted purine derivatives | ARIAD PHARMACEUTICALS, INC. | 2005-03-24 | — | — | US | disclosed |
| WO-2005009348-A2 | SUBSTITUTED PURINE DERIVATIVES | ARIAD PHARMACEUTICALS, INC. (US) | 2005-02-03 | — | — | WO | 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-20050065171-A1 | Substituted purine derivatives | ADORA2A, PNP, HPRT1 | ALDH1A1 611/4885TSHR 566/4885TDP1 297/4885 |
“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.