Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL24267213 | 0.83 | EPHX1 (0.38) | TP53KDM4EALDH1A1CHRM3HTT | |
| SCHEMBL15776933 | 0.82 | THRB (0.46) | TP53THRBALDH1A1SLC6A3 | |
| SCHEMBL12290766 | 0.82 | THRB (0.46) | TP53KDM4ETHRBALDH1A1SLC6A3 | |
| SCHEMBL11443344 | 0.82 | THRB (0.46) | TP53KDM4ETHRBALDH1A1SLC6A3 | |
| SCHEMBL1874858 | 0.80 | TP53 (0.47) | TP53KDM4ETHRBALDH1A1SLC6A3 | |
| SCHEMBL14679339 | 0.80 | TP53 (0.47) | TP53KDM4ETHRBALDH1A1SLC6A3 | |
| SCHEMBL7632176 | 0.80 | TP53 (0.47) | TP53KDM4ETHRBALDH1A1SLC6A3 | |
| SCHEMBL5536049 | 0.80 | TP53 (0.47) | TP53KDM4ETHRBALDH1A1SLC6A3 | |
| SCHEMBL12534071 | 0.78 | — | — | |
| SCHEMBL13616798 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3816164-B9 | ISOTHIAZOLO[5,4-D]PYRIMIDINE COMPOUND AS IRAK4 INHIBITOR | CHIA TAI TIANQING PHARMACEUTICAL GROUP CO LTD (CN) | 2024-07-10 | — | — | EP | disclosed |
| EP-3816164-A1 | ISOTHIAZOLO[5,4-D]PYRIMIDINE COMPOUND AS IRAK4 INHIBITOR | Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) | 2021-05-05 | — | — | EP | disclosed |