Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKLR | P30613 | 18/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8525044 | 0.87 | PKLR (0.49) | PKLR | |
| SCHEMBL8524665 | 0.84 | SLC16A3 (0.42) | PKLRMCL1CNR2 | |
| SCHEMBL8524454 | 0.81 | PKLR (0.49) | PKLR | |
| SCHEMBL1110102 | 0.78 | TUBB (0.46) | MCL1CNR2 | |
| SCHEMBL8525059 | 0.75 | HDAC2 (0.46) | CNR2 | |
| SCHEMBL8525757 | 0.74 | KMT2A (0.44) | PKLR | |
| Hydrochloric Acid SCHEMBL8525302 | 0.74 | F2 (0.56) | PKLR | |
| SCHEMBL8525755 | 0.73 | HSP90AA1 (0.49) | MCL1CNR2 | |
| SCHEMBL7358688 | 0.73 | PKLR (0.47) | PKLR | |
| SCHEMBL8525436 | 0.71 | HDAC2 (0.50) | CNR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999029670-A2 | AMINOCARBONYLTETRALIN AND DIHYDRONAPHTALENE DERIVATES AS THROMBIN INHIBITORS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-06-17 | — | — | WO | disclosed |