Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 20/20 | 0.58 |
| ▸ | ADRA1D | P25100 | 8/20 | 0.56 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.56 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL20177525 | 0.85 | ADRA1A (0.56) | ADRA1AADRA1DADRA1BADRA2A | |
| SCHEMBL20177638 | 0.85 | ADRA1A (0.56) | ADRA1AADRA1DADRA1BADRA2A | |
| SCHEMBL20177825 | 0.82 | ADRA1A (0.61) | ADRA1AADRA1DADRA1BADRA2A | |
| SCHEMBL20177794 | 0.82 | ADRA1A (0.61) | ADRA1AADRA1DADRA1BADRA2A | |
| SCHEMBL20177760 | 0.69 | ADRA1A (0.31) | ADRA1AADRA1DADRA1B | |
| SCHEMBL17148640 | 0.66 | ADRA1A (0.51) | ADRA1AADRA1DADRA1BADRA2A | |
| SCHEMBL4088031 | 0.66 | ADRA1A (0.59) | ADRA1AADRA1DADRA1BADRA2A | |
| SCHEMBL30826288 | 0.64 | HTR2C (0.49) | ADRA1AADRA1DADRA1BADRA2A | |
| SCHEMBL19182917 | 0.64 | ADRA1A (1.00) | ADRA1AADRA1DADRA1BADRA2A | |
| SCHEMBL11947782 | 0.63 | — | — |
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-2018092916-A1 | NITROGEN-CONTAINING POLYCYCLIC HETEROCYCLIC DERIVATIVE | 宇部興産株式会社 | 2018-05-24 | — | — | WO | disclosed |