Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.35 |
| ▸ | FAAH | O00519 | 2/20 | 0.35 |
| ▸ | FASN | P49327 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.33 |
| ▸ | INSR | P06213 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 2/20 | 0.32 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.32 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.32 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24253785 | 0.82 | TNIK (0.60) | TNIK | |
| SCHEMBL24253788 | 0.77 | GPR119 (0.41) | TNIKCYP1A2CYP2D6GPR119ACHE | |
| SCHEMBL24253879 | 0.69 | TNIK (0.60) | TNIK | |
| SCHEMBL24253971 | 0.68 | CYP2D6 (0.48) | CYP1A2CYP2D6HRH3ACHESLC22A2 | |
| SCHEMBL24253780 | 0.67 | CYP2D6 (0.48) | CYP1A2CYP2D6ACHESLC22A2SLC22A1 | |
| SCHEMBL24253870 | 0.66 | CYP2D6 (0.56) | CYP1A2CYP2D6HRH3ACHE | |
| SCHEMBL24253970 | 0.66 | CYP2D6 (0.58) | CYP1A2CYP2D6HRH3ACHE | |
| SCHEMBL31323039 | 0.61 | SMN1; SMN2 (0.66) | CYP1A2CYP2D6HRH3FAAHACHE | |
| SCHEMBL13645932 | 0.60 | CYP1A2 (0.69) | CYP1A2CYP2D6HRH3GAA | |
| SCHEMBL21766914 | 0.59 | CYP2D6 (0.65) | CYP1A2CYP2D6HRH3CYP3A4GAA |
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-2022034587-A1 | Traf2- AND Nck-INTERACTING KINASE (TNIK) INHIBITORS AND USES THEREOF | TNIK THERAPEUTICS LTD (IL) | 2022-02-17 | — | — | WO | disclosed |