Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL489179 | 0.79 | POLB (0.32) | POLBCA12CA1CA2CA9 | |
| SCHEMBL4109077 | 0.79 | POLB (0.49) | POLBSMN1; SMN2 | |
| SCHEMBL389987 | 0.79 | POLB (0.49) | POLBSMN1; SMN2 | |
| SCHEMBL200913 | 0.79 | POLB (0.49) | POLBSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL3055388 | 0.78 | POLB (0.47) | POLBSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL2337448 | 0.78 | POLB (0.47) | POLBSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5159954 | 0.78 | POLB (0.47) | POLBSMN1; SMN2 | |
| SCHEMBL8385960 | 0.76 | POLB (0.36) | POLBALDH1A1RAB9A | |
| SCHEMBL678254 | 0.76 | POLB (0.36) | POLBALDH1A1RAB9A | |
| SCHEMBL17222088 | 0.75 | PEPD (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1064298-B1 | INHIBITORS OF CASPASES | VERTEX PHARMA (US) | 2008-10-08 | — | — | EP | disclosed |