Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 7/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.48 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL1888523 | 0.95 | CYP3A4 (0.55) | CYP3A4CYP2C9CYP1A2CYP2D6NR1I2 | |
| Trifluoroacetic Acid SCHEMBL1891541 | 0.93 | CYP3A4 (0.49) | CYP3A4CYP2C9CYP1A2CYP2D6NR1I2 | |
| SCHEMBL1893334 | 0.92 | CYP3A4 (0.49) | CYP3A4CYP2C9CYP1A2CYP2D6NR1I2 | |
| SCHEMBL1895744 | 0.92 | CYP3A4 (0.47) | CYP3A4CYP2C9CYP1A2CYP2D6NR1I2 | |
| SCHEMBL1885984 | 0.92 | CYP3A4 (0.47) | CYP3A4CYP2C9CYP1A2CYP2D6NR1I2 | |
| SCHEMBL934003 | 0.92 | CYP3A4 (0.52) | CYP3A4CYP2C9CYP1A2CYP2D6NR1I2 | |
| SCHEMBL934483 | 0.92 | CYP3A4 (0.52) | CYP3A4CYP2C9CYP1A2CYP2D6NR1I2 | |
| SCHEMBL1891832 | 0.90 | CYP3A4 (0.44) | CYP3A4CYP2C9CYP1A2CYP2D6NR1I2 | |
| SCHEMBL1884813 | 0.90 | CYP3A4 (0.46) | CYP3A4CYP2C9CYP1A2CYP2D6NR1I2 | |
| SCHEMBL1892619 | 0.90 | CYP3A4 (0.45) | CYP3A4CYP2C9CYP1A2CYP2D6NR1I2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20110112100-A1 | Hepatitis C Virus Inhibitors | PFIZER INC. | 2011-05-12 | — | — | US | 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-20110112100-A1 | Hepatitis C Virus Inhibitors | HAVCR2, SLC10A1, HCCS | CYP3A4 237/4885CYP2C9 322/4885CYP1A2 247/4885 |
“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.