Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.32 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Danoprevir SCHEMBL11939425 | 0.94 | CYP3A4 (0.39) | CYP3A4ADRB3ADRA2BADRA2CDDB1 | |
| Danoprevir SCHEMBL7873481 | 0.94 | CYP3A4 (0.39) | CYP3A4ADRB3ADRA2BADRA2CDDB1 | |
| Danoprevir SCHEMBL10238838 | 0.94 | CYP3A4 (0.39) | CYP3A4ADRB3ADRA2BADRA2CDDB1 | |
| Danoprevir SCHEMBL11983895 | 0.94 | CYP3A4 (0.39) | CYP3A4ADRB3ADRA2BADRA2CDDB1 | |
| Danoprevir SCHEMBL12188232 | 0.94 | CYP3A4 (0.39) | CYP3A4ADRB3ADRA2BADRA2CDDB1 | |
| Danoprevir SCHEMBL23948382 | 0.94 | CYP3A4 (0.39) | CYP3A4ADRB3ADRA2BADRA2CDDB1 | |
| Danoprevir SCHEMBL6370805 | 0.94 | CYP3A4 (0.39) | CYP3A4ADRB3ADRA2BADRA2CDDB1 | |
| Danoprevir SCHEMBL17970113 | 0.94 | CYP3A4 (0.39) | CYP3A4ADRB3ADRA2BADRA2CDDB1 | |
| Danoprevir SCHEMBL1444650 | 0.94 | CYP3A4 (0.39) | CYP3A4ADRB3ADRA2BADRA2CDDB1 | |
| Danoprevir SCHEMBL1444652 | 0.94 | CYP3A4 (0.39) | CYP3A4ADRB3ADRA2BADRA2CDDB1 |
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-8106187-B2 | Process for the preparation of a macrocycle | ROCHE PALO ALTO LLC (US) | 2012-01-31 | — | — | US | disclosed |
| US-8106187-B2 | Process for the preparation of a macrocycle | ROCHE PALO ALTO LLC (US) | 2012-01-31 | — | — | US | disclosed |
| US-20100036116-A1 | Process for the preparation of a macrocycle | F. HOFFMANN-LA ROCHE AG (CH) | 2010-02-11 | — | — | US | disclosed |
| US-20100036116-A1 | Process for the preparation of a macrocycle | F. HOFFMANN-LA ROCHE AG (CH) | 2010-02-11 | — | — | 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-20100036116-A1 | Process for the preparation of a macrocycle | CTRL, PREP, RNASE1 | CYP3A4 36/4885ADRB3 4455/4885ADRA2B 4384/4885 |
“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.