Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 5/20 | 0.35 |
| ▸ | TGFBR2 | P37173 | 3/20 | 0.35 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23007811 | 1.00 | TGFBR1 (0.35) | TGFBR1TGFBR2CYP2E1CYP3A4CYP2A6 | |
| SCHEMBL23007807 | 0.82 | TGFBR1 (0.43) | TGFBR1TGFBR2CYP2A6PDE10A | |
| SCHEMBL29366477 | 0.82 | TGFBR1 (0.43) | TGFBR1TGFBR2CYP2A6PDE10A | |
| SCHEMBL29363247 | 0.75 | TGFBR1 (0.35) | TGFBR1PDE10AMKNK2 | |
| SCHEMBL23007890 | 0.75 | TGFBR1 (0.35) | TGFBR1PDE10AMKNK2 | |
| SCHEMBL23007722 | 0.73 | TGFBR1 (0.39) | TGFBR1TGFBR2CYP3A4MKNK2 | |
| SCHEMBL29366031 | 0.73 | TGFBR1 (0.39) | TGFBR1TGFBR2CYP3A4MKNK2 | |
| SCHEMBL23007810 | 0.72 | CNR2 (0.39) | TGFBR1 | |
| SCHEMBL29365713 | 0.72 | CNR2 (0.39) | TGFBR1 | |
| SCHEMBL23007796 | 0.67 | TGFBR1 (0.36) | TGFBR1TGFBR2MKNK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113993870-B | Imidazo pyrimidine compound containing fused ring group, preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2023-06-13 | — | — | CN | disclosed |
| CN-113993870-A | Imidazo pyrimidine compound containing polycyclic group, preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2022-01-28 | — | — | CN | disclosed |