Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 5/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2596852 | 0.76 | HTT (0.44) | HTTPTK2DYRK1ATGFBR1CYP3A4 | |
| SCHEMBL2598479 | 0.76 | TGFBR1 (0.37) | HTTPTK2DYRK1ATGFBR1CYP3A4 | |
| SCHEMBL23858513 | 0.68 | CCNT1 (0.42) | HTTPTK2CYP3A4 | |
| SCHEMBL2598373 | 0.65 | MAPKAPK2 (0.38) | HTTPTK2DYRK1ATGFBR1CYP3A4 | |
| SCHEMBL2598386 | 0.64 | DYRK1A (0.39) | DYRK1A | |
| SCHEMBL24495528 | 0.60 | NOS1 (0.34) | — | |
| SCHEMBL20112865 | 0.60 | NOS1 (0.46) | — | |
| SCHEMBL25241508 | 0.60 | NOS1 (0.33) | HTTPTK2TGFBR1CYP3A4CYP2C8 | |
| SCHEMBL3610870 | 0.60 | — | — | |
| SCHEMBL694559 | 0.59 | KDM4E (0.53) | HTTPTK2CYP3A4 |
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-2011146287-A1 | PYRAZOLO[4,3-B]PYRIDINE-7-AMINE INHIBITORS OF ALK5 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-11-24 | — | — | WO | disclosed |