Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 1/20 | 0.45 |
| ▸ | NUDT1 | P36639 | 3/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
| ▸ | TUBB | P07437 | 1/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.38 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.38 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.38 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.38 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.38 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.38 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.38 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.38 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30263737 | 0.78 | JAK1 (0.65) | JAK1NUDT1TUBB4ATUBBTUBA3C | |
| SCHEMBL45713 | 0.76 | NUDT1 (0.56) | JAK1NUDT1AHREGLN2 | |
| SCHEMBL24433 | 0.70 | CYP3A4 (0.56) | TUBB4ATUBBTUBA3CTUBA1BTUBA4A | |
| SCHEMBL14888861 | 0.68 | JAK1 (0.66) | JAK1NUDT1EGLN2MAPTHSP90AB1 | |
| SCHEMBL30263741 | 0.67 | JAK2 (0.64) | JAK1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL14721848 | 0.65 | CYP3A4 (0.50) | TUBB4ATUBBTUBA3CTUBA1BTUBA4A | |
| SCHEMBL30263697 | 0.65 | TUBB4A (0.50) | JAK1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL2640360 | 0.65 | JAK2 (0.56) | JAK1NUDT1EGLN2MAPTJAK2 | |
| SCHEMBL3304801 | 0.64 | JAK1 (0.75) | JAK1NUDT1EGLN2MAPTJAK2 | |
| SCHEMBL7435094 | 0.63 | CYP3A4 (0.42) | TUBB4ATUBBTUBA3CTUBA1BTUBA4A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115819425-A | Triazolo hexa-nitrogen heterocyclic-2-amine compound and preparation method and application thereof | 五邑大学 | 2023-03-21 | — | — | CN | disclosed |