Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 12/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.48 |
| ▸ | SIRT6 | Q8N6T7 | 2/20 | 0.48 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.48 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.48 |
| ▸ | PGR | P06401 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | RXRA | P19793 | 1/20 | 0.48 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.48 |
| ▸ | CCKAR | P32238 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | SLC10A1 | Q14973 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6505447 | 1.00 | HMGCR (0.56) | HMGCRCYP2C9SIRT6ABCC3ABCB11 | |
| SCHEMBL6503750 | 0.93 | HMGCR (0.62) | HMGCRCYP2C9SIRT6ABCC3ABCB11 | |
| SCHEMBL6503742 | 0.93 | HMGCR (0.62) | HMGCRCYP2C9SIRT6ABCC3ABCB11 | |
| SCHEMBL5732686 | 0.93 | HMGCR (0.54) | HMGCRCYP2C9SIRT6ABCC3ABCB11 | |
| SCHEMBL5732691 | 0.93 | HMGCR (0.54) | HMGCRCYP2C9SIRT6ABCC3ABCB11 | |
| SCHEMBL6492971 | 0.92 | HMGCR (0.60) | HMGCRCYP2C9SIRT6ABCC3ABCB11 | |
| SCHEMBL6500946 | 0.92 | HMGCR (0.60) | HMGCRCYP2C9SIRT6ABCC3ABCB11 | |
| SCHEMBL6492966 | 0.92 | HMGCR (0.60) | HMGCRCYP2C9SIRT6ABCC3ABCB11 | |
| SCHEMBL6502248 | 0.91 | HMGCR (0.68) | HMGCRCYP2C9KDM4EALDH1A1LMNA | |
| SCHEMBL6502244 | 0.91 | HMGCR (0.68) | HMGCRCYP2C9KDM4EALDH1A1LMNA |
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-2005051381-A1 | Substituted urea-octatydroindols as antagonists of melanin concentrating hormone receptor 1 (MCH1R) | BIOVITRUM AB (SE) | 2005-06-09 | — | — | WO | claimed |