Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.50 |
| ▸ | ESR1 | P03372 | 2/20 | 0.50 |
| ▸ | CCR1 | P32246 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.41 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27558490 | 1.00 | PFKFB3 (0.54) | PFKFB3ESR2ESR1CCR1ALDH1A1 | |
| SCHEMBL29954808 | 0.86 | CCR1 (0.48) | PFKFB3ESR2ESR1CCR1ALDH1A1 | |
| SCHEMBL18572379 | 0.86 | CCR1 (0.48) | PFKFB3ESR2ESR1CCR1ALDH1A1 | |
| Formamide SCHEMBL9731189 | 0.81 | PFKFB3 (0.51) | PFKFB3ESR2ESR1ALDH1A1MEN1 | |
| SCHEMBL31505363 | 0.81 | ESR2 (0.50) | PFKFB3ESR2ESR1ALDH1A1MEN1 | |
| SCHEMBL9731187 | 0.79 | ALDH1A1 (0.54) | PFKFB3ESR2ESR1ALDH1A1MEN1 | |
| SCHEMBL1002564 | 0.77 | BACE1 (0.53) | CCR1ALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL1914989 | 0.77 | BACE1 (0.53) | CCR1ALDH1A1NPC1RAB9AKMT2A | |
| SCHEMBL2278668 | 0.77 | CCR1 (0.47) | PFKFB3CCR1ALDH1A1MEN1NPC1 | |
| SCHEMBL10740204 | 0.77 | CYP1A2 (0.57) | PFKFB3CCR1ALDH1A1MEN1NPC1 |
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 |