Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL29950734 | 0.92 | GAA (0.41) | ACHEBCHEALDH1A1KMT2AMEN1 | |
| SCHEMBL29958124 | 0.85 | BCHE (0.49) | ACHEBCHEEGFRERBB2ALDH1A1 | |
| SCHEMBL29951413 | 0.85 | EGFR (0.45) | ACHEBCHEEGFRERBB2ALDH1A1 | |
| SCHEMBL1307134 | 0.85 | CA2 (0.48) | ACHEBCHEALDH1A1CNR2KMT2A | |
| SCHEMBL29950921 | 0.85 | BCHE (0.52) | ACHEBCHEALDH1A1LMNAKMT2A | |
| SCHEMBL29953134 | 0.83 | ALDH1A1 (0.43) | ACHEBCHEALDH1A1MAPT | |
| SCHEMBL29950877 | 0.82 | BCHE (0.52) | ACHEBCHEALDH1A1TAS2R14KMT2A | |
| SCHEMBL29957305 | 0.78 | CYP19A1 (0.42) | ACHEBCHEALDH1A1TAS2R14LMNA | |
| SCHEMBL29955781 | 0.77 | ALDH1A1 (0.43) | ALDH1A1LMNAKMT2AHTTRECQL | |
| SCHEMBL29144761 | 0.77 | ACHE (0.49) | ACHEBCHEEGFRERBB2ALDH1A1 |
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 |