Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 11/20 | 0.50 |
| ▸ | NR1I2 | O75469 | 4/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2189829 | 1.00 | CACNA1B (0.50) | CACNA1BNR1I2CYP3A4ALDH1A1USP2 | |
| SCHEMBL2190979 | 0.94 | CACNA1B (0.46) | CACNA1BNR1I2CYP3A4PTGS1PTGS2 | |
| SCHEMBL2190029 | 0.94 | CACNA1B (0.46) | CACNA1BNR1I2CYP3A4PTGS1PTGS2 | |
| SCHEMBL2189941 | 0.91 | CACNA1B (0.45) | CACNA1BNR1I2CYP3A4ALDH1A1USP2 | |
| SCHEMBL2188764 | 0.91 | CACNA1B (0.45) | CACNA1BNR1I2CYP3A4ALDH1A1USP2 | |
| SCHEMBL12415664 | 0.91 | CACNA1B (0.45) | CACNA1BNR1I2CYP3A4ALDH1A1USP2 | |
| SCHEMBL1728213 | 0.90 | CYP3A4 (0.47) | CACNA1BNR1I2CYP3A4ALDH1A1USP2 | |
| SCHEMBL2190611 | 0.90 | CYP3A4 (0.47) | CACNA1BNR1I2CYP3A4ALDH1A1USP2 | |
| SCHEMBL1710957 | 0.90 | CYP3A4 (0.47) | CACNA1BNR1I2CYP3A4ALDH1A1USP2 | |
| SCHEMBL2190814 | 0.89 | ALDH1A1 (0.47) | CACNA1BNR1I2CYP3A4ALDH1A1USP2 |
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-20110172236-A1 | SUBSTITUTED ARYL SULFONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | CHAKRAVARTY PRASUN K | 2011-07-14 | — | — | 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-20110172236-A1 | SUBSTITUTED ARYL SULFONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | TRPV1, TRPA1, CACNA1D | CACNA1B 23/4885NR1I2 765/4885CYP3A4 939/4885 |
“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.