Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 18/20 | 0.54 |
| ▸ | HCRTR2 | O43614 | 17/20 | 0.54 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28046546 | 0.88 | HCRTR1 (0.56) | HCRTR1HCRTR2 | |
| SCHEMBL1586336 | 0.87 | HCRTR1 (0.55) | HCRTR1HCRTR2 | |
| SCHEMBL3687324 | 0.77 | HCRTR1 (0.55) | HCRTR1HCRTR2PARP1 | |
| SCHEMBL2355116 | 0.76 | PARP1 (0.45) | PARP1 | |
| SCHEMBL302594 | 0.75 | HCRTR1 (0.40) | HCRTR1HCRTR2 | |
| SCHEMBL302595 | 0.73 | NOTUM (0.46) | HCRTR1HCRTR2 | |
| SCHEMBL15520028 | 0.73 | NOTUM (0.50) | — | |
| SCHEMBL16032475 | 0.73 | HCRTR1 (0.42) | HCRTR1HCRTR2 | |
| SCHEMBL2363877 | 0.72 | ALDH1A1 (0.43) | HCRTR1HCRTR2 | |
| SCHEMBL2358684 | 0.72 | NPC1 (0.52) | HCRTR1HCRTR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2350052-A2 | ANTIPROLIFERATIVE COMPOUNDS | Boehringer Ingelheim International GmbH (DE) | 2011-08-03 | — | — | EP | claimed |
| WO-2010034838-A2 | NEW CHEMICAL COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-04-01 | — | — | WO | claimed |