Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNC | P24863 | 3/20 | 0.42 |
| ▸ | CDK8 | P49336 | 3/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.40 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.40 |
| ▸ | ALDH1A2 | O94788 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA3 | P07451 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29380296 | 0.79 | HTR2A (0.41) | ERCC1ERCC4ALDH1A2ALDH1A1ALDH1A3 | |
| SCHEMBL30903411 | 0.78 | NOTUM (0.52) | CCNCCDK8ERCC1ERCC4NOTUM | |
| SCHEMBL14800197 | 0.78 | NOTUM (0.52) | CCNCCDK8ERCC1ERCC4NOTUM | |
| SCHEMBL1375296 | 0.77 | BRD4 (0.41) | ALDH1A1HSD17B10BRD4BRD9KAT2B | |
| SCHEMBL14966237 | 0.77 | BPTF (0.44) | ALDH1A1CA12CA9HSD17B10BRD4 | |
| SCHEMBL29702303 | 0.77 | BRD4 (0.41) | ALDH1A1HSD17B10BRD4BRD9KAT2B | |
| SCHEMBL29702195 | 0.76 | BPTF (0.43) | ALDH1A2ALDH1A1ALDH1A3BRD4HTR2A | |
| SCHEMBL1665815 | 0.73 | CTNNB1 (0.54) | CCNCCDK8NOTUMHTR2APASK | |
| SCHEMBL29491495 | 0.73 | CTNNB1 (0.54) | CCNCCDK8NOTUMHTR2APASK | |
| SCHEMBL22971729 | 0.73 | ALDH1A1 (0.39) | ALDH1A2ALDH1A1ALDH1A3KAT2B |
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-2021028806-A1 | HETEROCYCLIC WDR5 INHIBITORS AS ANTI-CANCER COMPOUNDS | NOVARTIS AG (CH) | 2021-02-18 | — | — | WO | disclosed |