Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 16/20 | 0.92 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | BDKRB1 | P46663 | 3/20 | 0.48 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10581662 | 0.99 | VCAM1 (0.90) | VCAM1ALDH1A1BDKRB1BDKRB2SMN1; SMN2 | |
| SCHEMBL10581814 | 0.92 | VCAM1 (0.82) | VCAM1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10580370 | 0.91 | VCAM1 (0.80) | VCAM1ALDH1A1 | |
| SCHEMBL9586069 | 0.87 | VCAM1 (0.90) | VCAM1ALDH1A1 | |
| SCHEMBL9319702 | 0.87 | VCAM1 (0.90) | VCAM1ALDH1A1 | |
| SCHEMBL10383532 | 0.85 | VCAM1 (0.80) | VCAM1ALDH1A1 | |
| SCHEMBL10388972 | 0.83 | VCAM1 (0.76) | VCAM1ALDH1A1 | |
| SCHEMBL6215796 | 0.80 | VCAM1 (1.00) | VCAM1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10581741 | 0.79 | VCAM1 (0.59) | VCAM1ALDH1A1BDKRB1BDKRB2SMN1; SMN2 | |
| SCHEMBL14093337 | 0.78 | VCAM1 (0.64) | VCAM1ALDH1A1BDKRB1BDKRB2 |
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-4880821-A | RADIATION SENSITIVITY | MERCK & CO., INC. (US) | 1989-11-14 | — | — | US | disclosed |