Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.33 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5802805 | 1.00 | SMN1; SMN2 (0.36) | SMN1; SMN2CA12CA1CA2ESR1 | |
| SCHEMBL1751285 | 0.84 | CA12 (0.40) | SMN1; SMN2CA12CA1CA2ESR1 | |
| SCHEMBL1751283 | 0.84 | CA12 (0.40) | SMN1; SMN2CA12CA1CA2ESR1 | |
| SCHEMBL10518873 | 0.81 | CA12 (0.38) | SMN1; SMN2CA12CA1CA2ESR1 | |
| SCHEMBL23846798 | 0.78 | CA12 (0.36) | SMN1; SMN2CA12CA1CA2ESR1 | |
| SCHEMBL14408185 | 0.78 | HPGD (0.36) | SMN1; SMN2CA12CA1CA2ESR1 | |
| SCHEMBL26503771 | 0.78 | CA12 (0.36) | SMN1; SMN2CA12CA1CA2ESR1 | |
| SCHEMBL4973069 | 0.76 | CA12 (0.35) | CA12CA1CA2ESR1CA9 | |
| SCHEMBL4973073 | 0.76 | CA12 (0.35) | CA12CA1CA2ESR1CA9 | |
| SCHEMBL22096868 | 0.75 | HPGD (0.36) | SMN1; SMN2HPGDGFERCACNA1BAPBA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006064484-A1 | AZABICYCLONONENE DERIVATIVES AS RENIN INHIBITORS | ACTELION PHARMACEUTICALS LTD (CH) | 2006-06-22 | — | — | WO | disclosed |