Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.45 |
| ▸ | VCAM1 | P19320 | 7/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SNCA | P37840 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9524443 | 0.86 | VCAM1 (0.48) | ALDH1A1KDM1APDE7AVCAM1KDM4E | |
| SCHEMBL9511525 | 0.80 | VCAM1 (0.56) | ALDH1A1KDM1AVCAM1KDM4EPOLB | |
| SCHEMBL29936572 | 0.80 | VCAM1 (0.56) | ALDH1A1KDM1AVCAM1KDM4EPOLB | |
| SCHEMBL10359525 | 0.75 | TSHR (0.53) | ALDH1A1POLBCYP3A4SMN1; SMN2TSHR | |
| SCHEMBL671271 | 0.75 | VCAM1 (0.54) | ALDH1A1KDM1AVCAM1KDM4EPOLB | |
| SCHEMBL4692660 | 0.75 | ALDH1A1 (0.56) | ALDH1A1PDE7ACYP3A4SMN1; SMN2TSHR | |
| SCHEMBL11801017 | 0.75 | TSHR (0.54) | ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL28555521 | 0.74 | SMN1; SMN2 (0.59) | ALDH1A1KDM1AVCAM1KDM4EPOLB | |
| Hydrochloric Acid SCHEMBL1725403 | 0.73 | VCAM1 (0.53) | ALDH1A1KDM1AVCAM1KDM4EPOLB | |
| SCHEMBL28860553 | 0.73 | TSHR (0.49) | ALDH1A1PDE7APOLBCYP3A4TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2419404-B1 | ANTI-VIRAL COMPOUNDS | ABBVIE INC (US) | 2015-11-04 | — | — | EP | disclosed |
| EP-2419404-A1 | ANTI-VIRAL COMPOUNDS | Abbott Laboratories (US) | 2012-02-22 | — | — | EP | disclosed |
| WO-2010120935-A1 | ANTI-VIRAL COMPOUNDS | ABBOTT LABORATORIES (US) | 2010-10-21 | — | — | WO | disclosed |