Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | TTK | P33981 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 2/20 | 0.39 |
| ▸ | NOS1 | P29475 | 2/20 | 0.39 |
| ▸ | NOS2 | P35228 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.34 |
| ▸ | APLNR | P35414 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | CCR8 | P51685 | 1/20 | 0.33 |
| ▸ | LOX | P28300 | 1/20 | 0.32 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.32 |
| ▸ | NCF1 | P14598 | 1/20 | 0.32 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2946870 | 0.78 | AURKA (0.46) | AURKATTKAURKBINCENPNOS3 | |
| SCHEMBL29424822 | 0.78 | AURKA (0.46) | AURKATTKAURKBINCENPNOS3 | |
| SCHEMBL25957083 | 0.77 | ALDH1A1 (0.39) | MAPTMEN1KMT2AAPLNRCCR1 | |
| SCHEMBL30294257 | 0.77 | AURKA (0.44) | AURKATTKAURKBINCENPNOS3 | |
| Hydrochloric Acid SCHEMBL10850408 | 0.77 | AURKA (0.44) | AURKATTKAURKBINCENPNOS3 | |
| SCHEMBL7899151 | 0.77 | AURKA (0.44) | AURKATTKAURKBINCENPNOS3 | |
| SCHEMBL8417801 | 0.77 | AURKA (0.44) | AURKATTKAURKBINCENPNOS3 | |
| SCHEMBL3380754 | 0.77 | AURKA (0.44) | AURKATTKAURKBINCENPNOS3 | |
| SCHEMBL2208595 | 0.75 | AURKA (0.43) | AURKATTKAURKBINCENPNOS3 | |
| SCHEMBL21598414 | 0.75 | AURKA (0.43) | AURKATTKAURKBINCENPNOS3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3299369-A1 | PYRIDO-AZAHETERECYDIC COMPOUND AND PREPARATION METHOD AND USE THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2018-03-28 | — | — | EP | disclosed |