Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAK1 | Q13153 | 2/20 | 0.47 |
| ▸ | SMO | Q99835 | 4/20 | 0.46 |
| ▸ | DYRK1A | Q13627 | 4/20 | 0.44 |
| ▸ | WNT1 | P04628 | 3/20 | 0.44 |
| ▸ | JAK2 | O60674 | 3/20 | 0.43 |
| ▸ | TYK2 | P29597 | 2/20 | 0.43 |
| ▸ | JAK1 | P23458 | 2/20 | 0.43 |
| ▸ | ITK | Q08881 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | UBE2N | P61088 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PRKAB2 | O43741 | 4/20 | 0.42 |
| ▸ | PRKAG1 | P54619 | 4/20 | 0.42 |
| ▸ | PRKAA2 | P54646 | 4/20 | 0.42 |
| ▸ | PRKAA1 | Q13131 | 4/20 | 0.42 |
| ▸ | PRKAG3 | Q9UGI9 | 4/20 | 0.42 |
| ▸ | PRKAG2 | Q9UGJ0 | 4/20 | 0.42 |
| ▸ | PRKAB1 | Q9Y478 | 4/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3384172 | 0.86 | ACR (0.47) | PAK1DYRK1AWNT1JAK2TYK2 | |
| SCHEMBL3385649 | 0.83 | NPC1 (0.50) | DYRK1AWNT1ALDH1A1POLBKMT2A | |
| SCHEMBL3386038 | 0.78 | DYRK1A (0.48) | DYRK1AWNT1JAK2TYK2JAK1 | |
| SCHEMBL3386591 | 0.78 | KDR (0.50) | PAK1DYRK1AITKALDH1A1KMT2A | |
| SCHEMBL3383259 | 0.77 | MAPT (0.57) | ITKALDH1A1KMT2AROCK2ROCK1 | |
| SCHEMBL3383247 | 0.76 | HPGD (0.53) | JAK2TYK2JAK1ALDH1A1KMT2A | |
| SCHEMBL3386831 | 0.75 | NPC1 (0.54) | ALDH1A1POLBPRKAG1PRKAA1PRKAB1 | |
| SCHEMBL3386126 | 0.75 | PTGDR2 (0.43) | PAK1DYRK1AWNT1JAK2TYK2 | |
| SCHEMBL3385551 | 0.73 | SGK1 (0.47) | DYRK1AWNT1ITKPOLBKMT2A | |
| SCHEMBL3384625 | 0.73 | KDR (0.58) | DYRK1AITKROCK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010064875-A2 | NOVEL INDAZOLE DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS PROTEIN KINASE INHIBITORS FOR PROLIFERATIVE DISEASES TREATMENT, AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME AS AN ACTIVE INGREDIENT | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2010-06-10 | — | — | WO | claimed |
| WO-2010064875-A2 | NOVEL INDAZOLE DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS PROTEIN KINASE INHIBITORS FOR PROLIFERATIVE DISEASES TREATMENT, AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME AS AN ACTIVE INGREDIENT | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2010-06-10 | — | — | WO | disclosed |