Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 3/20 | 0.46 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | CCR3 | P51677 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1806797 | 0.86 | HSD11B1 (0.50) | CACNA1BHSD11B1PRKAA2MGLLMAPT | |
| SCHEMBL1810904 | 0.86 | PRKAA2 (0.45) | CACNA1BHSD11B1TSHRPRKAA2HTT | |
| SCHEMBL12099450 | 0.84 | EPHX2 (0.44) | CACNA1BHSD11B1TSHRPRKAA2MGLL | |
| SCHEMBL1807766 | 0.83 | PRKAA2 (0.48) | CACNA1BHSD11B1TSHRPRKAA2MGLL | |
| SCHEMBL1807419 | 0.83 | CACNA1B (0.45) | CACNA1BHSD11B1TSHRPRKAA2HTT | |
| SCHEMBL16784856 | 0.82 | TSHR (0.44) | CACNA1BHSD11B1TSHRPRKAA2HTT | |
| SCHEMBL1807159 | 0.82 | PRKAA2 (0.45) | CACNA1BHSD11B1TSHRPRKAA2MGLL | |
| SCHEMBL1809803 | 0.82 | HSD11B1 (0.46) | CACNA1BHSD11B1PRKAA2HTTTDP1 | |
| SCHEMBL1813071 | 0.79 | KMT2A (0.46) | CACNA1BHSD11B1TSHRMGLLALDH1A1 | |
| SCHEMBL1808574 | 0.78 | FKBP1A (0.48) | HSD11B1MGLLSMN1; SMN2GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011058766-A1 | ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS | RAQUALIA PHARMA INC. (JP) | 2011-05-19 | — | — | WO | claimed |
| WO-2011058766-A1 | ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS | RAQUALIA PHARMA INC. (JP) | 2011-05-19 | — | — | WO | disclosed |