Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 10/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | PDE6D | O43924 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9752988 | 1.00 | HMGCR (0.40) | HMGCRALDH1A1CYP3A4PDE6DNR1I2 | |
| SCHEMBL9753324 | 0.89 | HMGCR (0.51) | HMGCRALDH1A1CYP3A4PDE6DNR1I2 | |
| SCHEMBL9753286 | 0.85 | HMGCR (0.41) | HMGCRALDH1A1CYP3A4PDE6DNR1I2 | |
| SCHEMBL9753292 | 0.85 | HMGCR (0.41) | HMGCRALDH1A1CYP3A4PDE6DNR1I2 | |
| SCHEMBL9753009 | 0.85 | HMGCR (0.40) | HMGCRALDH1A1CYP3A4PDE6DNR1I2 | |
| SCHEMBL9753010 | 0.85 | HMGCR (0.40) | HMGCRALDH1A1CYP3A4PDE6DNR1I2 | |
| SCHEMBL9753078 | 0.82 | HMGCR (0.40) | HMGCRALDH1A1CYP3A4PDE6DNR1I2 | |
| SCHEMBL9753380 | 0.82 | HMGCR (0.40) | HMGCRALDH1A1CYP3A4PDE6DNR1I2 | |
| SCHEMBL9753079 | 0.82 | HMGCR (0.40) | HMGCRALDH1A1CYP3A4PDE6DNR1I2 | |
| SCHEMBL9753372 | 0.82 | HMGCR (0.40) | HMGCRALDH1A1CYP3A4PDE6DNR1I2 |
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-1991018903-A1 | PYRROLOPYRIDAZINE COMPOUNDS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1991-12-12 | — | — | WO | disclosed |