Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM1 | Q13255 | 10/20 | 0.50 |
| ▸ | GRM5 | P41594 | 9/20 | 0.50 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.50 |
| ▸ | NAMPT | P43490 | 1/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.47 |
| ▸ | TNK2 | Q07912 | 2/20 | 0.46 |
| ▸ | JAK1 | P23458 | 1/20 | 0.46 |
| ▸ | LIPC | P11150 | 1/20 | 0.46 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.46 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.44 |
| ▸ | ATR | Q13535 | 1/20 | 0.44 |
| ▸ | BTK | Q06187 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5337540 | 0.89 | GRM1 (0.58) | GRM1GRM5PDK4NAMPTTNK2 | |
| SCHEMBL3988457 | 0.84 | PDK4 (0.56) | GRM1GRM5PDK4NAMPTCYP11B2 | |
| SCHEMBL901679 | 0.84 | MAPT (0.46) | — | |
| SCHEMBL2811392 | 0.82 | PDK4 (0.60) | GRM1GRM5PDK4NAMPTCYP11B2 | |
| SCHEMBL31747276 | 0.82 | PDK4 (0.54) | GRM1GRM5PDK4NAMPTCYP11B2 | |
| SCHEMBL7831576 | 0.81 | PDK4 (0.58) | GRM1GRM5PDK4NAMPTCYP11B2 | |
| SCHEMBL30308912 | 0.81 | GRM1 (0.64) | GRM1GRM5PDK4NAMPTTNK2 | |
| SCHEMBL3169756 | 0.81 | PDK4 (0.55) | GRM1GRM5PDK4NAMPTCYP11B2 | |
| SCHEMBL29924834 | 0.81 | PDK4 (0.55) | GRM1GRM5PDK4NAMPTCYP11B2 | |
| SCHEMBL1364792 | 0.80 | PDK4 (0.57) | GRM1GRM5PDK4NAMPTCYP11B2 |
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-2441755-A1 | Pyridine- and isoquinoline-derivatives as Syk and JAK kinase inhibitors | Almirall, S.A. (ES) | 2012-04-18 | — | — | EP | disclosed |
| WO-2012041476-A1 | PYRIDINE AND ISOQUINOLINE DERIVATIVES AS SYK- AND JAK-KINASE INHIBITORS | ALMIRALL, S.A. (ES) | 2012-04-05 | — | — | WO | disclosed |