Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 5/20 | 0.61 |
| ▸ | CA2 | P00918 | 3/20 | 0.52 |
| ▸ | MGLL | Q99685 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.52 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.50 |
| ▸ | KMO | O15229 | 1/20 | 0.46 |
| ▸ | TTR | P02766 | 1/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | LPL | P06858 | 1/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 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 | |
|---|---|---|---|---|
| SCHEMBL28393591 | 1.00 | AHR (0.61) | AHRCA2MGLLCA1CYP1B1 | |
| SCHEMBL28424779 | 0.82 | CA2 (0.47) | AHRCA2MGLLCA1ENPP2 | |
| SCHEMBL130450 | 0.81 | TTR (0.61) | AHRCA2CA1ENPP2TTR | |
| Boric Acid SCHEMBL30873596 | 0.78 | AHR (0.61) | AHRCA2MGLLCA1CYP1B1 | |
| SCHEMBL13667445 | 0.78 | CA2 (0.78) | CA2MGLLCA1ENPP2TSHR | |
| SCHEMBL18394607 | 0.78 | CA2 (0.78) | CA2MGLLCA1ENPP2TSHR | |
| SCHEMBL806835 | 0.78 | CA2 (0.78) | CA2MGLLCA1ENPP2TSHR | |
| SCHEMBL29769221 | 0.78 | AHR (1.00) | AHRCYP1B1KMOSCN9AESR2 | |
| SCHEMBL137915 | 0.78 | AHR (1.00) | AHRCYP1B1KMOSCN9AESR2 | |
| SCHEMBL1954438 | 0.77 | ENPP2 (0.84) | AHRCA2MGLLCA1ENPP2 |
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 |