Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 2/20 | 0.54 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.34 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3303841 | 0.79 | AHR (0.58) | AHRCYP11B2NUDT1 | |
| SCHEMBL13457590 | 0.78 | AHR (0.56) | AHRCYP11B2NUDT1 | |
| SCHEMBL45713 | 0.76 | NUDT1 (0.56) | AHRCYP11B2JAK3NUDT1 | |
| SCHEMBL18366725 | 0.72 | PDE10A (0.44) | — | |
| SCHEMBL18366669 | 0.72 | NUDT1 (0.65) | JAK2JAK3PTK2NUDT1 | |
| SCHEMBL16439318 | 0.72 | AHR (0.50) | AHRCYP11B2JAK2JAK3PTK2 | |
| SCHEMBL30676207 | 0.72 | AHR (0.78) | AHRCYP11B2NUDT1 | |
| SCHEMBL30601204 | 0.71 | AHR (1.00) | AHRCYP11B2 | |
| SCHEMBL18341116 | 0.71 | AHR (0.49) | AHRCYP11B2NUDT1 | |
| SCHEMBL28485655 | 0.69 | AHR (0.47) | AHRCYP11B2PTK2NUDT1 |
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-118108717-A | Organic compound and application thereof, and organic electroluminescent device comprising organic compound | 北京鼎材科技有限公司 | 2024-05-31 | — | — | CN | disclosed |
| CN-107759587-B | [1,2,4] triazolo [1,5-a ] pyridine compound and preparation method and medical application thereof | 中国医药研究开发中心有限公司 | 2021-01-26 | — | — | CN | disclosed |