Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 19/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.73 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2596933 | 1.00 | TGFBR1 (0.73) | TGFBR1CYP3A4CYP1A2CYP2C8CYP2D6 | |
| SCHEMBL2596881 | 0.87 | TGFBR1 (0.73) | TGFBR1CYP3A4 | |
| SCHEMBL2596799 | 0.84 | TGFBR1 (1.00) | TGFBR1CYP3A4 | |
| SCHEMBL2596782 | 0.84 | TGFBR1 (0.69) | TGFBR1CYP3A4 | |
| SCHEMBL2596757 | 0.84 | TGFBR1 (0.71) | TGFBR1CYP3A4 | |
| SCHEMBL2596975 | 0.84 | TGFBR1 (0.71) | TGFBR1CYP3A4 | |
| SCHEMBL2596756 | 0.84 | TGFBR1 (0.71) | TGFBR1CYP3A4 | |
| SCHEMBL2596746 | 0.83 | TGFBR1 (0.88) | TGFBR1CYP3A4 | |
| SCHEMBL2596980 | 0.83 | TGFBR1 (0.67) | TGFBR1CYP3A4 | |
| SCHEMBL2596806 | 0.82 | TGFBR1 (0.66) | TGFBR1CYP3A4 |
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 |