Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 3/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.48 |
| ▸ | PLAU | P00749 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 6/20 | 0.45 |
| ▸ | RAB9A | P51151 | 6/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.45 |
| ▸ | F2 | P00734 | 1/20 | 0.45 |
| ▸ | PLG | P00747 | 1/20 | 0.45 |
| ▸ | PLAT | P00750 | 1/20 | 0.45 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.45 |
| ▸ | KLK1 | P06870 | 1/20 | 0.45 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL16146269 | 0.82 | IRAK1 (0.60) | HDAC2HDAC1HDAC3NCOR2PLAU | |
| Hydrochloric Acid SCHEMBL16146311 | 0.81 | IRAK1 (0.59) | HDAC2HDAC1HDAC3NCOR2PLAU | |
| SCHEMBL2949633 | 0.76 | HDAC2 (0.63) | HDAC2HDAC1HDAC3NCOR2PLAU | |
| SCHEMBL29364540 | 0.76 | HDAC2 (0.63) | HDAC2HDAC1HDAC3NCOR2PLAU | |
| SCHEMBL10280428 | 0.75 | IRAK1 (0.45) | HDAC2HDAC1HDAC3NCOR2ALDH1A1 | |
| SCHEMBL27498643 | 0.73 | HDAC2 (0.59) | HDAC2HDAC1HDAC3NCOR2PLAU | |
| SCHEMBL9116112 | 0.72 | HDAC2 (0.58) | HDAC2HDAC1HDAC3NCOR2PLAU | |
| SCHEMBL11701111 | 0.72 | HDAC2 (0.58) | HDAC2HDAC1HDAC3NCOR2PLAU | |
| SCHEMBL9812753 | 0.71 | HDAC2 (0.60) | HDAC2HDAC1HDAC3NCOR2PLAU | |
| SCHEMBL11200897 | 0.70 | HDAC2 (0.59) | HDAC2HDAC1HDAC3NCOR2PLAU |
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-110003219-A | Pyrazolo [1,5A] pyrimidine and thieno [3,2B] pyrimidine derivatives as IRAK4 regulator | 弗·哈夫曼-拉罗切有限公司 | 2019-07-12 | — | — | CN | disclosed |
| CN-105367577-B | Pyrazolo [1,5A] pyrimidine and thieno [3,2B] pyrimidine derivatives as IRAK4 regulator | 弗·哈夫曼-拉罗切有限公司 | 2019-04-23 | — | — | CN | disclosed |