Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 3/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28204239 | 0.91 | SMN1; SMN2 (0.41) | CYP4F2CYP4A11SMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL5705878 | 0.89 | CYP4F2 (0.44) | CYP4F2CYP4A11SMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL10592233 | 0.80 | CYP4F2 (0.37) | CYP4F2CYP4A11SMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL5918601 | 0.76 | ALDH1A1 (0.35) | CYP4F2CYP4A11ALDH1A1 | |
| Acrylic Acid SCHEMBL31511918 | 0.75 | CYP4F2 (0.39) | CYP4F2CYP4A11LMNAALDH1A1TSHR | |
| SCHEMBL10593381 | 0.73 | SMN1; SMN2 (0.43) | CYP4F2CYP4A11SMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL28468380 | 0.71 | ALDH1A1 (0.38) | LMNAALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL1711205 | 0.71 | TSHR (0.33) | LMNATSHR | |
| SCHEMBL28900263 | 0.70 | CYP4F2 (0.44) | CYP4F2CYP4A11SMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL29129485 | 0.70 | CYP4F2 (0.39) | CYP4F2CYP4A11SMN1; SMN2LMNAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111825677-A | Selective NK-3 receptor antagonist and preparation and application thereof | 明慧医药（杭州）有限公司 | 2020-10-27 | — | — | CN | disclosed |