Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.39 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.39 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.38 |
| ▸ | HRH2 | P25021 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.37 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.37 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | SCD5 | Q86SK9 | 2/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | KIF11 | P52732 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8963220 | 1.00 | HRH3 (0.42) | HRH3KCNH2EGLN2P2RY14PAX8 | |
| SCHEMBL8962812 | 0.95 | GRIA1 (0.39) | HRH3KCNH2EGLN2GRIA1GRIA2 | |
| SCHEMBL8962800 | 0.95 | GRIA1 (0.39) | HRH3KCNH2EGLN2GRIA1GRIA2 | |
| SCHEMBL9300526 | 0.93 | KDM1A (0.38) | HRH3KCNH2EGLN2P2RY14PAX8 | |
| SCHEMBL8963065 | 0.91 | GRIA1 (0.37) | HRH3KCNH2EGLN2P2RY14GRIA1 | |
| SCHEMBL8962770 | 0.87 | ESR2 (0.38) | GRIA1GRIA2GRIA3MAOBHSD11B1 | |
| SCHEMBL8962766 | 0.87 | ESR2 (0.38) | GRIA1GRIA2GRIA3MAOBHSD11B1 | |
| SCHEMBL9475715 | 0.85 | HRH3 (0.42) | HRH3KCNH2EGLN2P2RY14PAX8 | |
| SCHEMBL9475718 | 0.85 | HRH3 (0.42) | HRH3KCNH2EGLN2P2RY14PAX8 | |
| SCHEMBL9168960 | 0.85 | HRH3 (0.45) | HRH3KCNH2EGLN2P2RY14PAX8 |
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-0559860-B1 | HALOVINYL-DERIVATIVES | HOFFMANN LA ROCHE (CH) | 1996-02-14 | — | — | EP | disclosed |