Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CMA1 | P23946 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 1/20 | 0.32 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.31 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.30 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.30 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.30 |
| ▸ | HTR3B | O95264 | 1/20 | 0.30 |
| ▸ | HTR3A | P46098 | 1/20 | 0.30 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.30 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15416052 | 0.74 | CHEK1 (0.37) | CHEK1LIMK1MEN1KMT2A | |
| SCHEMBL15416013 | 0.73 | TP53 (0.38) | CHEK1LIMK1MEN1KMT2A | |
| SCHEMBL15416741 | 0.68 | CNR1 (0.40) | MEN1KMT2A | |
| SCHEMBL4786389 | 0.66 | CHEK1 (0.50) | CHEK1LIMK1CMA1AHRPDE7A | |
| SCHEMBL11386072 | 0.60 | CHEK1 (0.55) | CHEK1LIMK1CMA1AHRHTR3A | |
| SCHEMBL9571241 | 0.59 | PDE7A (0.49) | MEN1KMT2APDE7A | |
| SCHEMBL23092730 | 0.58 | CHEK1 (0.39) | CHEK1LIMK1CMA1AHR | |
| SCHEMBL3966441 | 0.56 | BRD4 (0.46) | MEN1KMT2ACMA1AHRPDE7A | |
| SCHEMBL19905814 | 0.56 | AHR (0.43) | CMA1AHRHTR3EHTR3BHTR3A | |
| SCHEMBL13868943 | 0.56 | CHEK1 (0.59) | CHEK1LIMK1CMA1AHRHTR3E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2872502-A1 | NOVEL INDAZOLES FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS INFECTION | F. Hoffmann-La Roche AG (CH) | 2015-05-20 | — | — | EP | disclosed |
| WO-2014009302-A1 | NOVEL INDAZOLES FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS INFECTION | F. HOFFMANN-LA ROCHE AG (CH) | 2014-01-16 | — | — | WO | disclosed |