Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.60 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.60 |
| ▸ | KDM5A | P29375 | 1/20 | 0.41 |
| ▸ | CHUK | O15111 | 9/20 | 0.37 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 2/20 | 0.35 |
| ▸ | IKBKB | O14920 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | AKT2 | P31751 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6034022 | 0.76 | ADORA1 (1.00) | ADORA2AADORA1CHUKKDRKDM4E | |
| SCHEMBL30791495 | 0.76 | MAP3K14 (0.45) | KDM4EALDH1A1FEN1MTORAKT1 | |
| SCHEMBL23019354 | 0.75 | TRPA1 (0.56) | ADORA2AADORA1CLK4KDRKDM4E | |
| SCHEMBL16321240 | 0.73 | ADORA1 (0.71) | ADORA2AADORA1CHUKKDRKDM4E | |
| SCHEMBL18356737 | 0.73 | ADORA1 (0.71) | ADORA2AADORA1CHUKKDRIKBKB | |
| SCHEMBL16891621 | 0.73 | ADORA1 (0.66) | ADORA2AADORA1KDRKDM4EALDH1A1 | |
| SCHEMBL16049353 | 0.72 | PDPK1 (0.40) | MTOR | |
| SCHEMBL29926976 | 0.72 | FEN1 (0.37) | ADORA2AADORA1KDM4EALDH1A1FEN1 | |
| SCHEMBL19897377 | 0.71 | KDM5A (0.43) | KDM5AKDM4EALDH1A1PIK3CDAKT1 | |
| SCHEMBL31361714 | 0.71 | CDC7 (0.41) | IKBKBKDM4EFEN1MTORAKT1 |
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 |