Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 2/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.38 |
| ▸ | ABAT | P80404 | 1/20 | 0.38 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | FBP1 | P09467 | 2/20 | 0.37 |
| ▸ | VCP | P55072 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3048927 | 1.00 | XDH (0.42) | XDHCYP19A1TSHRERN1NFE2L2 | |
| SCHEMBL348330 | 0.85 | CYP19A1 (0.56) | XDHCYP19A1TSHRERN1NFE2L2 | |
| SCHEMBL1548019 | 0.85 | CYP19A1 (0.50) | XDHCYP19A1TSHRERN1NFE2L2 | |
| SCHEMBL24934311 | 0.82 | CYP19A1 (0.40) | CYP19A1TSHRNFE2L2VCAM1ALDH1A1 | |
| SCHEMBL16951590 | 0.82 | CYP19A1 (0.40) | CYP19A1TSHRNFE2L2ALDH1A1HIF1A | |
| SCHEMBL30508453 | 0.81 | HSPB1 (0.44) | XDHERN1ALDH1A1 | |
| SCHEMBL25409075 | 0.81 | HSPB1 (0.44) | XDHERN1ALDH1A1 | |
| SCHEMBL7203812 | 0.80 | CYP19A1 (0.62) | CYP19A1TSHRVCAM1ALDH1A1HIF1A | |
| SCHEMBL1172437 | 0.80 | CYP19A1 (0.55) | CYP19A1TSHRVCAM1ALDH1A1HIF1A | |
| Fluoride SCHEMBL27574861 | 0.78 | CYP19A1 (0.59) | CYP19A1TSHRVCAM1ALDH1A1HIF1A |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |