Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.36 |
| ▸ | ABAT | P80404 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL435100 | 0.85 | — | — | |
| Flurothyl SCHEMBL28708358 | 0.80 | ALDH1A1 (0.42) | ALDH1A1L3MBTL1POLBALDH5A1ABAT | |
| Trifluoroacetic Acid SCHEMBL1481977 | 0.78 | P4HTM (0.46) | ALDH1A1L3MBTL1POLBKDM4EP4HTM | |
| Trifluoroacetic Acid SCHEMBL1481982 | 0.78 | P4HTM (0.46) | ALDH1A1L3MBTL1POLBKDM4EP4HTM | |
| Trifluoroacetic Acid SCHEMBL27673223 | 0.74 | HCAR2 (0.41) | ALDH1A1L3MBTL1POLBPTGS2 | |
| Nicotinaldehyde SCHEMBL31529397 | 0.72 | MAPT (0.50) | ALDH1A1L3MBTL1KDM4ERAB9A | |
| Nicotinaldehyde SCHEMBL29915617 | 0.72 | MAPT (0.50) | ALDH1A1L3MBTL1KDM4ERAB9A | |
| Trifluoroacetic Acid SCHEMBL30473139 | 0.72 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1ALDH5A1ABATKDM4E | |
| Benzaldehyde SCHEMBL28521088 | 0.71 | ALDH1A1 (0.64) | ALDH1A1ALDH5A1ABAT | |
| Trifluoroacetic Acid SCHEMBL6497341 | 0.71 | HSD17B10 (0.64) | ALDH1A1ALDH5A1ABAT |
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-114163437-A | Substituted pyrazolo [1,5-A ] pyridine compounds as RET kinase inhibitors | 阿雷生物药品公司 | 2022-03-11 | — | — | CN | disclosed |
| CN-110382494-B | Substituted pyrazolo [1,5-A ] pyridine compounds as RET kinase inhibitors | 阿雷生物药品公司 | 2021-11-16 | — | — | CN | disclosed |