Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 2/20 | 0.42 |
| ▸ | TGFBR1 | P36897 | 3/20 | 0.42 |
| ▸ | ACHE | P22303 | 3/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.39 |
| ▸ | SOS2 | Q07890 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ACP1 | P24666 | 3/20 | 0.38 |
| ▸ | KMO | O15229 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | GPR65 | Q8IYL9 | 1/20 | 0.37 |
| ▸ | NCF1 | P14598 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | APAF1 | O14727 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Urea SCHEMBL1817197 | 0.95 | GRM2 (0.48) | GRM2TGFBR1ACHEKMOMAPK1 | |
| SCHEMBL1816075 | 0.88 | ADORA2A (0.48) | TGFBR1ACHEADORA2ANCF1 | |
| SCHEMBL1819085 | 0.81 | GRM2 (0.44) | GRM2TGFBR1ACHEADORA2AACP1 | |
| SCHEMBL3390029 | 0.74 | F2 (0.43) | TGFBR1ADORA2A | |
| SCHEMBL12090572 | 0.73 | ACP1 (0.50) | TGFBR1ACP1 | |
| SCHEMBL12090613 | 0.73 | ACP1 (0.48) | GRM2TGFBR1ACP1 | |
| SCHEMBL12090592 | 0.73 | ACP1 (0.53) | TGFBR1ACP1 | |
| SCHEMBL12657827 | 0.73 | GRM2 (0.44) | GRM2TGFBR1ACP1MAPK1APAF1 | |
| SCHEMBL1817198 | 0.73 | GRM2 (0.44) | GRM2ACP1MAPK1APAF1 | |
| SCHEMBL12090569 | 0.73 | TGFBR1 (0.57) | TGFBR1ACP1 |
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-2011054433-A1 | HETEROARYLAMINOQUINOLINES AS TGF-BETA RECEPTOR KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2011-05-12 | — | — | WO | disclosed |