Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 3/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | PDE2A | O00408 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 3/20 | 0.35 |
| ▸ | CHUK | O15111 | 2/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10135688 | 0.89 | ROCK1 (0.44) | ROCK1CYP19A1PRKCZTBXAS1HRH3 | |
| SCHEMBL10135624 | 0.86 | ROCK1 (0.46) | ROCK1CYP19A1PRKCZMAPK1ALDH1A1 | |
| SCHEMBL10135637 | 0.86 | ROCK1 (0.46) | ROCK1CYP19A1PRKCZMAPK1ALDH1A1 | |
| SCHEMBL10135694 | 0.86 | ROCK1 (0.43) | ROCK1CYP19A1PRKCZALDH1A1SMN1; SMN2 | |
| SCHEMBL10135871 | 0.84 | ROCK1 (0.40) | ROCK1CYP19A1PRKCZTBXAS1ROCK2 | |
| SCHEMBL10135677 | 0.83 | ROCK1 (0.45) | ROCK1CYP19A1PRKCZMAPK1ALDH1A1 | |
| SCHEMBL10135701 | 0.82 | ROCK1 (0.44) | ROCK1CYP19A1PRKCZMAPK1ALDH1A1 | |
| SCHEMBL10135734 | 0.82 | ROCK1 (0.44) | ROCK1CYP19A1PRKCZMAPK1ALDH1A1 | |
| SCHEMBL10135774 | 0.81 | HRH3 (0.44) | ROCK1CYP19A1PRKCZALDH1A1HRH3 | |
| SCHEMBL10135790 | 0.81 | HRH3 (0.44) | ROCK1CYP19A1PRKCZALDH1A1HRH3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8951997-B2 | Substituted isoquinoline derivative | D. WESTERN THERAPEUTICS INSTITUTE, INC. (JP) | 2015-02-10 | — | — | US | disclosed |
| US-20120035159-A1 | SUBSTITUTED ISOQUINOLINE DERIVATIVE | D. WESTERN THERAPEUTICS INSTITUTE, INC (JP) | 2012-02-09 | — | — | 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-20120035159-A1 | SUBSTITUTED ISOQUINOLINE DERIVATIVE | SULT1A1, SULT1E1, SULT2A1 | ROCK1 1837/4885CYP19A1 2996/4885PRKCZ 3050/4885 |
“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.