Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.37 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.36 |
| ▸ | ATR | Q13535 | 2/20 | 0.36 |
| ▸ | ATRIP | Q8WXE1 | 2/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.35 |
| ▸ | CLK1 | P49759 | 1/20 | 0.35 |
| ▸ | CLK2 | P49760 | 1/20 | 0.35 |
| ▸ | CLK3 | P49761 | 1/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.35 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29722091 | 0.79 | TRPA1 (0.38) | CYP1A2ADORA1PDCD1CD274ATR | |
| SCHEMBL23147607 | 0.79 | TRPA1 (0.38) | CYP1A2ADORA1PDCD1CD274ATR | |
| SCHEMBL16612853 | 0.77 | BRD4 (0.43) | ALDH1A1KDM4EADORA1PDCD1CD274 | |
| SCHEMBL29957561 | 0.76 | DYRK1A (0.38) | CYP1A2ADORA1DYRK1AADORA2AKMT2A | |
| SCHEMBL26106331 | 0.76 | DYRK1A (0.38) | ALDH1A1KDM4EMAPTADORA1PDCD1 | |
| SCHEMBL30611953 | 0.76 | DYRK1A (0.38) | ALDH1A1KDM4EMAPTADORA1PDCD1 | |
| SCHEMBL3360828 | 0.76 | PRKCI (0.44) | ADORA1PDCD1CD274ATRATRIP | |
| SCHEMBL23148049 | 0.76 | AXL (0.44) | ADORA1PDCD1CD274ATRATRIP | |
| SCHEMBL23152002 | 0.71 | LMNA (0.48) | ALDH1A1KDM4ECYP1A2MAPTMCL1 | |
| SCHEMBL29935837 | 0.71 | LMNA (0.48) | ALDH1A1KDM4ECYP1A2MAPTMCL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |