Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TLR4 | O00206 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 5/20 | 0.39 |
| ▸ | CA12 | O43570 | 4/20 | 0.39 |
| ▸ | CA1 | P00915 | 4/20 | 0.39 |
| ▸ | CA9 | Q16790 | 4/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | ANTXR2 | P58335 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17775913 | 0.94 | CYP2D6 (0.46) | CYP2D6THRBHSD17B10TLR4CA2 | |
| SCHEMBL23651823 | 0.94 | CYP2D6 (0.46) | CYP2D6THRBHSD17B10TLR4CA2 | |
| SCHEMBL270320 | 0.94 | CYP2D6 (0.46) | CYP2D6THRBHSD17B10TLR4CA2 | |
| SCHEMBL24105675 | 0.94 | CYP2D6 (0.46) | CYP2D6THRBHSD17B10TLR4CA2 | |
| SCHEMBL29774502 | 0.87 | ANTXR2 (0.46) | CYP2D6THRBHSD17B10TLR4CA2 | |
| SCHEMBL23651803 | 0.87 | ANTXR2 (0.46) | CYP2D6THRBHSD17B10TLR4CA2 | |
| SCHEMBL29525898 | 0.87 | ANTXR2 (0.46) | CYP2D6THRBHSD17B10TLR4CA2 | |
| SCHEMBL269962 | 0.87 | ANTXR2 (0.46) | CYP2D6THRBHSD17B10TLR4CA2 | |
| SCHEMBL22076372 | 0.87 | CYP2D6 (0.45) | CYP2D6THRBHSD17B10CA2CA12 | |
| SCHEMBL22076469 | 0.87 | CYP2D6 (0.45) | CYP2D6THRBHSD17B10CA2CA12 |
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-2016079332-A1 | GEL FORMULATIONS FOR IMPROVING IMMUNOTHERAPY | TECHNICAL UNIVERSITY OF DENMARK (DK) | 2016-05-26 | — | — | WO | disclosed |