Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20187754 | 1.00 | BCHE (0.44) | BCHEAURKAHTR2CMCHR1 | |
| SCHEMBL21799068 | 0.90 | — | — | |
| SCHEMBL30114879 | 0.88 | BCHE (0.46) | BCHEAURKAHTR2CMCHR1 | |
| SCHEMBL20187744 | 0.88 | BCHE (0.46) | BCHEAURKAHTR2CMCHR1 | |
| SCHEMBL20191064 | 0.86 | ABL1 (0.52) | HTR2CMCHR1 | |
| SCHEMBL20190513 | 0.84 | — | — | |
| SCHEMBL30530308 | 0.84 | — | — | |
| SCHEMBL21799069 | 0.84 | JAK2 (0.47) | — | |
| SCHEMBL30530282 | 0.84 | JAK2 (0.47) | — | |
| SCHEMBL20188120 | 0.84 | RAB9A (0.49) | AURKAHTR2CMCHR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3544685-B1 | HETROARYLAMINE COMPOUNDS FOR MODULATING THE HEDGEHOG PATHWAY AND PREPARING METHOD AND USES THEREOF | DEV CT BIOTECHNOLOGY (TW) | 2023-01-04 | — | — | EP | disclosed |