Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP26A1 | O43174 | 6/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | CYP24A1 | Q07973 | 3/20 | 0.41 |
| ▸ | CYP27A1 | Q02318 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | TNF | P01375 | 1/20 | 0.40 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.40 |
| ▸ | THRA | P10827 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14061860 | 0.91 | DGAT1 (0.50) | CYP26A1ITGB3ITGA2BCYP11B1CYP11B2 | |
| SCHEMBL17195438 | 0.88 | CYP24A1 (0.46) | CYP26A1ITGB3ITGA2BCYP11B1CYP11B2 | |
| SCHEMBL7798239 | 0.86 | CYP26A1 (0.57) | CYP26A1ITGB3ITGA2BCYP11B1CYP11B2 | |
| SCHEMBL14061633 | 0.84 | CYP24A1 (0.60) | CYP26A1ITGB3ITGA2BCYP24A1CYP27A1 | |
| SCHEMBL10341531 | 0.82 | CYP26A1 (0.59) | CYP26A1ITGB3ITGA2BDGAT1CASP1 | |
| SCHEMBL13774776 | 0.81 | CYP24A1 (0.50) | CYP26A1ITGB3ITGA2BCYP11B1CYP11B2 | |
| SCHEMBL4096787 | 0.81 | CYP24A1 (0.50) | CYP26A1ITGB3ITGA2BCYP11B1CYP11B2 | |
| SCHEMBL14137067 | 0.80 | CYP26A1 (0.47) | CYP26A1CYP11B1CYP11B2CYP24A1CYP27A1 | |
| SCHEMBL8531158 | 0.79 | KMT2A (0.48) | — | |
| SCHEMBL14061800 | 0.79 | CYP24A1 (0.48) | CYP26A1ITGB3ITGA2BCYP11B1CYP11B2 |
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-4692447-A | HYPOTENSIVE, VASODILATOR, ANTITHROMBOTIC, ANTIAGGREGANT, CYTOPROTECTIVE | BOEHRINGER BIOCHEMIA ROBIN, S.P.A. (IT) | 1987-09-08 | — | — | US | disclosed |