Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | PRKDC | P78527 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CTSV | O60911 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
| ▸ | TUBB | P07437 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29950813 | 0.81 | ALDH1A1 (0.39) | ALDH1A1KDM4EMAPTHSD17B10CTSL | |
| SCHEMBL29957701 | 0.78 | ALDH1A1 (0.37) | ALDH1A1MAPTNPSR1TDP1 | |
| SCHEMBL29955208 | 0.76 | ALDH1A1 (0.56) | ERN1HTTALDH1A1KDM4EMAPT | |
| SCHEMBL29952591 | 0.74 | MAPT (0.52) | HTTALDH1A1MAPTCTSVCTSL | |
| SCHEMBL17479616 | 0.71 | NQO2 (0.62) | ERN1HTTALDH1A1KDM4EMAPT | |
| SCHEMBL29950867 | 0.71 | ALDH1A1 (0.53) | HTTALDH1A1KDM4EMAPTHSD17B10 | |
| SCHEMBL29952812 | 0.69 | MAPT (0.52) | HTTALDH1A1MAPTCTSVCTSL | |
| SCHEMBL24252539 | 0.67 | ERN1 (0.63) | ERN1HTTALDH1A1KDM4EMAPT | |
| SCHEMBL29955402 | 0.66 | MAPT (0.44) | ALDH1A1KDM4EMAPTHSD17B10 | |
| SCHEMBL3223692 | 0.65 | ALDH1A1 (0.50) | ALDH1A1KDM4EMAPTHSD17B10 |
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 |