Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | BRD2 | P25440 | 1/20 | 0.39 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.39 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20177635 | 0.91 | KDM1A (0.41) | CCKBRCTSLCTSBCTSKALDH1A1 | |
| SCHEMBL18270477 | 0.89 | FPR2 (0.45) | CCKBRBRD4BRD2BRD3NAAA | |
| SCHEMBL20177510 | 0.79 | FPR2 (0.52) | CTSLNAAA | |
| SCHEMBL20177720 | 0.78 | NAAA (0.41) | CCKBRALDH1A1GAANAAA | |
| SCHEMBL20177860 | 0.77 | CCKBR (0.48) | CCKBRCTSLCTSBCTSKALDH1A1 | |
| SCHEMBL20177491 | 0.75 | CCKBR (0.47) | CCKBRBRD4BRD2BRD3CTSL | |
| SCHEMBL20177524 | 0.75 | FPR2 (0.50) | — | |
| SCHEMBL20177557 | 0.72 | CA1 (0.42) | BRD4BRD2BRD3 | |
| SCHEMBL18264306 | 0.72 | FPR2 (0.48) | — | |
| SCHEMBL18264305 | 0.72 | FPR2 (0.48) | — |
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 |