Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.62 |
| ▸ | LTA4H | P09960 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | ESR1 | P03372 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29957497 | 1.00 | BACE1 (0.62) | BACE1LTA4HKDM4EPOLBGAA | |
| SCHEMBL29951665 | 0.99 | LTA4H (0.61) | BACE1LTA4HKDM4EPOLBGAA | |
| SCHEMBL2821196 | 0.91 | KDM4E (0.62) | KDM4EALDH1A1SMN1; SMN2L3MBTL1ESR1 | |
| SCHEMBL2557377 | 0.87 | KMT2A (0.63) | BACE1LTA4HKDM4EGAAALDH1A1 | |
| SCHEMBL2558114 | 0.87 | LTA4H (0.49) | BACE1LTA4HKDM4EPOLBGAA | |
| SCHEMBL15329359 | 0.87 | KDM4E (0.56) | BACE1LTA4HKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL2555039 | 0.86 | KDM4E (0.60) | LTA4HKDM4EALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL4083675 | 0.84 | HRH3 (0.56) | LTA4HKDM4EPOLBHRH3 | |
| SCHEMBL2561445 | 0.84 | KDM4E (0.62) | KDM4ESMN1; SMN2HTTLMNAMAPK1 | |
| SCHEMBL4089600 | 0.83 | LTA4H (0.56) | LTA4HKDM4EPOLBHRH3 |
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 |