Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | CASP1 | P29466 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | ALPL | P05186 | 1/20 | 0.49 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.47 |
| ▸ | F7 | P08709 | 1/20 | 0.47 |
| ▸ | F3 | P13726 | 1/20 | 0.47 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.46 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.46 |
| ▸ | MYC | P01106 | 2/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | DHODH | Q02127 | 1/20 | 0.45 |
| ▸ | MARS1 | P56192 | 1/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1219180 | 0.77 | CNR1 (0.48) | ALDH1A1TP53TSHRCASP1SMN1; SMN2 | |
| SCHEMBL442223 | 0.77 | ALDH1A1 (0.58) | ALDH1A1TP53TSHRCASP1SMN1; SMN2 | |
| SCHEMBL9336033 | 0.77 | ALDH1A1 (0.49) | ALDH1A1TP53TSHRCASP1SMN1; SMN2 | |
| SCHEMBL9558834 | 0.77 | TSHR (0.68) | ALDH1A1TP53TSHRCASP1SMN1; SMN2 | |
| SCHEMBL19514758 | 0.75 | ALDH1A1 (0.71) | ALDH1A1TP53TSHRCASP1SMN1; SMN2 | |
| SCHEMBL17785974 | 0.73 | ALDH1A1 (0.53) | ALDH1A1TP53TSHRCASP1SMN1; SMN2 | |
| SCHEMBL10900803 | 0.73 | DYRK1A (0.61) | ALDH1A1TP53TSHRCASP1SMN1; SMN2 | |
| SCHEMBL224469 | 0.73 | ALDH1A1 (1.00) | ALDH1A1TP53TSHRCASP1SMN1; SMN2 | |
| SCHEMBL111279 | 0.73 | TSHR (1.00) | ALDH1A1TP53TSHRCASP1SMN1; SMN2 | |
| SCHEMBL29986499 | 0.73 | HSD11B1 (0.50) | ALDH1A1TP53TSHRALPLKDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1618127-A2 | THE SEVERE ACUTE RESPIRATORY SYNDROME CORONAVIRUS | CHIRON CORPORATION (US) | 2006-01-25 | — | — | EP | disclosed |
| EP-1537099-A1 | PYRROLE BASED INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 2005-06-08 | — | — | EP | disclosed |
| WO-2004092360-A2 | THE SEVERE ACUTE RESPIRATORY SYNDROME CORONAVIRUS | CHIRON CORPORATION (US) | 2004-10-28 | — | — | WO | disclosed |
| WO-2004018455-A1 | PYRROLE BASED INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 2004-03-04 | — | — | WO | disclosed |