Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | ACLY | P53396 | 1/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 3/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | ACACA | Q13085 | 1/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.31 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4961008 | 0.97 | CYP2C9 (0.39) | CYP2C9ALDH1A1TSHRACLYDGAT1 | |
| SCHEMBL3691934 | 0.86 | CYP2C9 (0.36) | CYP2C9ALDH1A1TSHRACLYDGAT1 | |
| SCHEMBL8052693 | 0.84 | CYP2C9 (0.42) | CYP2C9ALDH1A1TSHRACLYDGAT1 | |
| SCHEMBL14448144 | 0.80 | TSHR (0.44) | ALDH1A1TSHRCYP2D6CYP2C19HIF1A | |
| SCHEMBL838759 | 0.78 | TET2 (0.40) | ALDH1A1TSHRCYP2D6CYP2C19HIF1A | |
| SCHEMBL3687624 | 0.78 | CYP2C9 (0.37) | CYP2C9ALDH1A1TSHRACLYCYP2D6 | |
| SCHEMBL13104262 | 0.77 | CYP2C9 (0.39) | CYP2C9ALDH1A1TSHRACLYCYP2D6 | |
| SCHEMBL8171344 | 0.76 | ALDH1A1 (0.41) | CYP2C9ALDH1A1TSHRACLYACACB | |
| SCHEMBL5050665 | 0.76 | TSHR (0.41) | ALDH1A1TSHRCYP2D6CYP2C19HIF1A | |
| SCHEMBL3142027 | 0.76 | ALDH1A1 (0.38) | ALDH1A1TSHRCYP2D6CYP2C19HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| US-4447431-A | VIRICIDES, ANTIINFLAMMATORY AND SUNCREEN AGENT | CIBA-GEIGY CORPORATION (US) | 1984-05-08 | — | — | US | disclosed |