Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.41 |
| ▸ | SCN4A | P35499 | 2/20 | 0.41 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
| ▸ | HPGDS | O60760 | 3/20 | 0.41 |
| ▸ | COMT | P21964 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.36 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18622292 | 0.72 | SCN4A (0.54) | HCAR2NOTUMSCN4APDPK1HPGDS | |
| SCHEMBL17791787 | 0.71 | HCAR2 (0.61) | HCAR2NOTUMSCN4APDPK1HPGDS | |
| SCHEMBL3068150 | 0.69 | SCN4A (0.62) | HCAR2NOTUMSCN4APDPK1HPGDS | |
| SCHEMBL22470596 | 0.69 | KDM4C (0.38) | PPARA | |
| SCHEMBL3362110 | 0.68 | PDPK1 (0.50) | HCAR2NOTUMSCN4APDPK1HPGDS | |
| SCHEMBL14646357 | 0.65 | SCN4A (0.42) | HCAR2NOTUMSCN4APDPK1HPGDS | |
| SCHEMBL30761809 | 0.65 | NOTUM (0.52) | HCAR2NOTUMSCN4APDPK1HPGDS | |
| SCHEMBL16394567 | 0.64 | PPARA (0.41) | CYP2A6PPARA | |
| SCHEMBL2670725 | 0.64 | PPARA (0.45) | NOTUMCYP19A1NPC1RAB9AMAPT | |
| SCHEMBL17279817 | 0.63 | POLB (0.77) | NOTUMSCN4APDPK1HPGDSPOLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115260175-A | 5- (pyrazole-5-yl) -1,2,4-oxadiazole substituted benzamide compound and preparation method and application thereof | 浙江工业大学 | 2022-11-01 | — | — | CN | claimed |
| CN-114920734-A | 5- (pyrazole-5-yl) -1,2, 4-oxadiazole substituted benzamide compounds and preparation method and application thereof | 浙江工业大学 | 2022-08-19 | — | — | CN | claimed |
| CN-114920734-A | 5- (pyrazole-5-yl) -1,2, 4-oxadiazole substituted benzamide compounds and preparation method and application thereof | 浙江工业大学 | 2022-08-19 | — | — | CN | disclosed |