Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | EPAS1 | Q99814 | 5/20 | 0.35 |
| ▸ | VEGFA | P15692 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | ARNT | P27540 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 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 | |
|---|---|---|---|---|
| SCHEMBL3027842 | 0.88 | CYP3A4 (0.45) | CYP3A4KCNH2CYP2C9CYP2C19EPAS1 | |
| SCHEMBL3022832 | 0.87 | CYP3A4 (0.56) | CYP3A4KCNH2CYP2C9CYP2C19HTR2A | |
| SCHEMBL3031457 | 0.87 | CYP3A4 (0.46) | CYP3A4KCNH2CYP2C9CYP2C19HTR2A | |
| SCHEMBL3027563 | 0.81 | CYP3A4 (0.50) | CYP3A4KCNH2CYP2C9CYP2C19EPAS1 | |
| SCHEMBL3033135 | 0.80 | KCNH2 (0.47) | CYP3A4KCNH2CYP2C9CYP2C19EPAS1 | |
| SCHEMBL4441198 | 0.80 | CYP3A4 (0.47) | CYP3A4KCNH2CYP2C9CYP2C19EPAS1 | |
| SCHEMBL1344824 | 0.79 | CYP3A4 (0.48) | CYP3A4KCNH2CYP2C9CYP2C19EPAS1 | |
| SCHEMBL3635141 | 0.77 | CYP3A4 (0.58) | CYP3A4CYP2C9CYP2C19EPAS1VEGFA | |
| SCHEMBL12135665 | 0.77 | CYP3A4 (0.61) | CYP3A4KCNH2CYP2C9CYP2C19HTR2A | |
| SCHEMBL3037532 | 0.77 | CYP3A4 (0.56) | CYP3A4KCNH2CYP2C9CYP2C19HTR2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8304419-B2 | Chemical compounds | GLAXOSMITHKLINE LLC (US) | 2012-11-06 | — | — | US | disclosed |
| US-20100216746-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2010-08-26 | — | — | US | disclosed |
| EP-2166856-A1 | CHEMICAL COMPOUNDS | GlaxoSmithKline LLC (US) | 2010-03-31 | — | — | EP | disclosed |
| WO-2008154271-A1 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-12-18 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20100216746-A1 | CHEMICAL COMPOUNDS | SAMHD1, POLRMT, NUDT1 | CYP3A4 169/4885KCNH2 4114/4885CYP2C9 720/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.