Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDGFRB | P09619 | 10/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 10/20 | 0.43 |
| ▸ | TNIK | Q9UKE5 | 3/20 | 0.42 |
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.38 |
| ▸ | MET | P08581 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | CDK8 | P49336 | 1/20 | 0.36 |
| ▸ | CLK2 | P49760 | 1/20 | 0.36 |
| ▸ | CDK7 | P50613 | 1/20 | 0.36 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 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 | |
|---|---|---|---|---|
| SCHEMBL25523902 | 0.86 | TNIK (0.45) | PDGFRBPDGFRATNIKEGFRGRIN2B | |
| SCHEMBL31538928 | 0.82 | PDGFRB (0.51) | PDGFRBPDGFRAMETMAP4K4CLK4 | |
| SCHEMBL25521682 | 0.82 | PDGFRB (0.51) | PDGFRBPDGFRAMETMAP4K4CLK4 | |
| SCHEMBL25523542 | 0.81 | EGLN1 (0.37) | PDGFRBPDGFRATNIKEGFRMET | |
| SCHEMBL25523539 | 0.80 | CYP1A2 (0.42) | PDGFRBPDGFRAEGFRMAP4K4CDK8 | |
| SCHEMBL25520053 | 0.77 | ESR1 (0.43) | MAP4K4ESR2KDM4E | |
| SCHEMBL25521675 | 0.75 | ABCG2 (0.42) | PDGFRBPDGFRAEGFRGRIN2BESR2 | |
| SCHEMBL15686689 | 0.73 | PDGFRB (0.40) | PDGFRBPDGFRATNIKMETAKR1C3 | |
| SCHEMBL25523536 | 0.72 | PDGFRB (0.39) | PDGFRBPDGFRAEGFRMAP4K4CLK4 | |
| SCHEMBL25523411 | 0.72 | AAK1 (0.44) | CDK8ACVR1 |
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-2023086428-A2 | NOVEL MODULATORS OF THE ARYL HYDROCARBON RECEPTOR AND METHODS OF USE THEREOF | ALLIANTHERA (SUZHOU) BIOPHARMACEUTICAL CO., LTD. (CN) | 2023-05-19 | — | — | WO | disclosed |