Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.96 |
| ▸ | BPTF | Q12830 | 1/20 | 0.69 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.53 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CNR2 | P34972 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.49 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.49 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL421732 | 1.00 | CYP1A2 (0.96) | CYP1A2BPTFLMNAHTTCHRNB2 | |
| SCHEMBL1849545 | 0.98 | CYP1A2 (1.00) | CYP1A2BPTFLMNAHTTCHRNB2 | |
| SCHEMBL9990416 | 0.96 | CYP1A2 (0.88) | CYP1A2BPTFLMNAHTTCHRNB2 | |
| SCHEMBL6360151 | 0.87 | BPTF (0.80) | CYP1A2BPTFLMNAHTTCHRNB2 | |
| SCHEMBL6354020 | 0.86 | BPTF (0.84) | CYP1A2BPTFLMNAHTTCHRNB2 | |
| SCHEMBL20929374 | 0.84 | CYP1A2 (0.69) | CYP1A2BPTFLMNAHTTKMT2A | |
| SCHEMBL5238778 | 0.84 | BPTF (0.87) | CYP1A2BPTFLMNAHTTCHRNB2 | |
| SCHEMBL6352737 | 0.84 | CYP1A2 (0.69) | CYP1A2BPTFLMNAHTTKMT2A | |
| SCHEMBL14503215 | 0.84 | CYP1A2 (0.75) | CYP1A2BPTFLMNAHTTALDH1A1 | |
| SCHEMBL1770262 | 0.83 | CYP1A2 (0.69) | CYP1A2BPTFLMNAHTTCHRNB2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115397806-A | Aryl and heteroaryl compounds and their therapeutic use in conditions associated with altered activity of galactocerebrosidase | 增益治疗股份有限公司 | 2022-11-25 | — | — | CN | disclosed |
| EP-4065546-A1 | ARYL AND HETEROARYL COMPOUNDS, AND THERAPEUTIC USES THEREOF IN CONDITIONS ASSOCIATED WITH THE ALTERATION OF THE ACTIVITY OF GALACTOCEREBROSIDASE | Gain Therapeutics SA (CH) | 2022-10-05 | — | — | EP | disclosed |