Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 2/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.31 |
| ▸ | PDPK1 | O15530 | 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 | |
|---|---|---|---|---|
| SCHEMBL20177493 | 0.82 | ADRA1A (0.36) | ADRA1A | |
| SCHEMBL20177838 | 0.79 | — | — | |
| SCHEMBL20177638 | 0.77 | ADRA1A (0.56) | ADRA1AADRA1DADRA1B | |
| SCHEMBL20177525 | 0.77 | ADRA1A (0.56) | ADRA1AADRA1DADRA1B | |
| SCHEMBL20177936 | 0.69 | KDM1A (0.32) | — | |
| SCHEMBL20177500 | 0.66 | DPP4 (0.43) | — | |
| SCHEMBL17514687 | 0.65 | KDM1A (0.35) | — | |
| SCHEMBL17514785 | 0.62 | ABCB1 (0.37) | — | |
| SCHEMBL20177480 | 0.62 | FPR2 (0.31) | — | |
| SCHEMBL20177572 | 0.60 | PDE4A (0.39) | — |
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 |