Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.40 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.40 |
| ▸ | VNN1 | O95497 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.31 |
| ▸ | DPP4 | P27487 | 3/20 | 0.30 |
| ▸ | DPP8 | Q6V1X1 | 3/20 | 0.30 |
| ▸ | DPP9 | Q86TI2 | 3/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18347997 | 1.00 | PIK3CD (0.44) | PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL19869628 | 1.00 | PIK3CD (0.44) | PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL18347996 | 1.00 | PIK3CD (0.44) | PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL22916981 | 0.90 | PIK3CD (0.52) | PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL25514814 | 0.90 | PIK3CD (0.52) | PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL15451852 | 0.87 | VNN1 (0.34) | PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL18348016 | 0.85 | PIK3CD (0.41) | PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL23011816 | 0.82 | PIK3CD (0.46) | PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL21963795 | 0.82 | PIK3CD (0.46) | PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL21963809 | 0.82 | PIK3CD (0.46) | PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023096995-A1 | COMPOSITIONS AND METHODS COMPRISING SUBSTITUTED N-(2-CHLORO-6-METHYLPHENYL)-2-((6-(6-MEMBERED HETEROCYCLOALKYL)-2-METHYLPYRIMIDIN-4-YL)AMINO)THIAZOLE-5-CARBOXAMIDE ANALOGUES | ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. (US) | 2023-06-01 | — | — | WO | disclosed |
| US-7276520-B2 | Bicyclic piperidine derivatives as melanocortin-4 receptor agonists | MERCK & CO., INC. (US) | 2007-10-02 | — | — | US | disclosed |