Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 6/20 | 0.45 |
| ▸ | CDK1 | P06493 | 4/20 | 0.45 |
| ▸ | IDH1 | O75874 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.36 |
| ▸ | CDK2 | P24941 | 2/20 | 0.36 |
| ▸ | CDK9 | P50750 | 2/20 | 0.36 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25597187 | 0.76 | IDH1 (0.45) | KDRCDK1IDH1 | |
| SCHEMBL29314862 | 0.74 | ADORA1 (0.64) | KDRCDK1ADORA1ADORA2AADORA2B | |
| SCHEMBL29314783 | 0.72 | KDR (0.47) | KDRCDK1ADORA1ADORA2AADORA2B | |
| SCHEMBL3613255 | 0.72 | TEK (0.51) | KDRIDH1 | |
| SCHEMBL20406383 | 0.70 | PDE10A (0.46) | PIK3CABTK | |
| SCHEMBL29315239 | 0.70 | HSP90AB1 (0.42) | KDRCDK1CCNT1CCNA2CDK2 | |
| SCHEMBL564719 | 0.70 | GRM5 (0.49) | L3MBTL1 | |
| SCHEMBL29530525 | 0.70 | GRM5 (0.49) | L3MBTL1 | |
| SCHEMBL21549440 | 0.69 | CDK7 (0.57) | KDRCDK1CCNT1CDK2CDK9 | |
| SCHEMBL23019360 | 0.69 | KDR (0.41) | KDRCDK1ADORA1ADORA2ACCNT1 |
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-3782986-B1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2024-07-10 | — | — | EP | disclosed |