Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 5/20 | 0.73 |
| ▸ | ALK | Q9UM73 | 6/20 | 0.57 |
| ▸ | INSR | P06213 | 5/20 | 0.54 |
| ▸ | FLT3 | P36888 | 4/20 | 0.54 |
| ▸ | ABL1 | P00519 | 3/20 | 0.54 |
| ▸ | NPM1 | P06748 | 2/20 | 0.54 |
| ▸ | BCR | P11274 | 2/20 | 0.54 |
| ▸ | IGF1R | P08069 | 1/20 | 0.54 |
| ▸ | TTK | P33981 | 3/20 | 0.53 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.53 |
| ▸ | INCENP | Q9NQS7 | 3/20 | 0.53 |
| ▸ | AURKA | O14965 | 2/20 | 0.53 |
| ▸ | KIT | P10721 | 3/20 | 0.50 |
| ▸ | SRC | P12931 | 3/20 | 0.50 |
| ▸ | NPY2R | P49146 | 1/20 | 0.43 |
| ▸ | MET | P08581 | 1/20 | 0.42 |
| ▸ | MST1R | Q04912 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10063195 | 0.88 | ITK (0.70) | ITKALKINSRFLT3ABL1 | |
| SCHEMBL10063188 | 0.87 | ITK (0.81) | ITKALKINSRFLT3ABL1 | |
| SCHEMBL10063186 | 0.85 | ITK (1.00) | ITKALKINSRFLT3ABL1 | |
| SCHEMBL10063189 | 0.84 | ITK (0.77) | ITKALKINSRFLT3ABL1 | |
| SCHEMBL10063184 | 0.84 | ITK (0.83) | ITKALKINSRFLT3ABL1 | |
| SCHEMBL10063196 | 0.84 | ITK (0.83) | ITKALKINSRFLT3ABL1 | |
| SCHEMBL10063194 | 0.83 | ITK (0.81) | ITKALKINSRFLT3ABL1 | |
| SCHEMBL10081134 | 0.82 | ITK (0.70) | ITKALKINSRFLT3ABL1 | |
| SCHEMBL10063126 | 0.78 | ITK (0.67) | ITKALKINSRFLT3TTK | |
| SCHEMBL10063120 | 0.76 | ITK (0.64) | ITKALKINSRTTKAURKB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1831168-B1 | PYRID-2-ONES USEFUL AS INHIBITORS OF TEC FAMILY PROTEIN KINASES FOR THE TREATMENT OF INFLAMMATORY, PROLIFERATIVE AND IMMUNOLOGICALLY-MEDIATED DISEASES. | VERTEX PHARMA (US) | 2014-07-02 | — | — | EP | disclosed |