Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ULK1 | O75385 | 1/20 | 0.48 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 8/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.35 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30861108 | 0.79 | ULK1 (0.52) | ULK1CHEK1CYP1A2CYP2C19CLK4 | |
| SCHEMBL27227837 | 0.79 | ULK1 (0.52) | ULK1CHEK1CYP1A2CYP2C19CLK4 | |
| SCHEMBL30397427 | 0.77 | CDK1 (0.37) | ULK1CYP1A2CYP2C19CLK4GLA | |
| SCHEMBL25526753 | 0.77 | CDK1 (0.37) | ULK1CYP1A2CYP2C19CLK4GLA | |
| SCHEMBL25236525 | 0.76 | ALDH1A1 (0.55) | ULK1CHEK1CYP1A2CYP2C19CLK4 | |
| SCHEMBL30397498 | 0.76 | ALDH1A1 (0.55) | ULK1CHEK1CYP1A2CYP2C19CLK4 | |
| SCHEMBL23331243 | 0.76 | KDM4E (0.41) | CHEK1KDM4ESTK17AFLT3 | |
| SCHEMBL23296517 | 0.74 | CHEK1 (0.38) | CHEK1LRRK2STK17AFLT3 | |
| SCHEMBL22652222 | 0.72 | ULK1 (0.36) | ULK1CHEK1LRRK2STK17AFLT3 | |
| SCHEMBL22648372 | 0.72 | SMN1; SMN2 (0.49) | ULK1CHEK1CYP1A2CYP2C19CYP3A4 |
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-2023091726-A1 | INHIBITORS OF CYCLIN‑DEPENDENT KINASE 12 (CDK12) | SYROS PHARMACEUTICALS, INC. (US) | 2023-05-25 | — | — | WO | disclosed |