Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | PPM1B | O75688 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | PPP1CC | P36873 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23986657 | 1.00 | EPHX2 (0.42) | EPHX2ALDH1A1MEN1KMT2ACYP3A4 | |
| SCHEMBL22828634 | 1.00 | EPHX2 (0.42) | EPHX2ALDH1A1MEN1KMT2ACYP3A4 | |
| SCHEMBL16728406 | 1.00 | EPHX2 (0.42) | EPHX2ALDH1A1MEN1KMT2ACYP3A4 | |
| Hydrochloric Acid SCHEMBL29928929 | 0.98 | EPHX2 (0.41) | EPHX2ALDH1A1MEN1KMT2ACYP3A4 | |
| SCHEMBL31178057 | 0.91 | POLB (0.49) | EPHX2ALDH1A1MEN1KMT2ACYP3A4 | |
| SCHEMBL1862636 | 0.91 | POLB (0.49) | EPHX2ALDH1A1MEN1KMT2ACYP3A4 | |
| Hydrochloric Acid SCHEMBL4279690 | 0.89 | POLB (0.47) | EPHX2ALDH1A1MEN1KMT2AHSD11B1 | |
| SCHEMBL8718164 | 0.89 | EPHX2 (0.45) | EPHX2ALDH1A1MEN1KMT2ACYP3A4 | |
| SCHEMBL19229939 | 0.89 | EPHX2 (0.45) | EPHX2ALDH1A1MEN1KMT2ACYP3A4 | |
| SCHEMBL20283492 | 0.87 | ALDH1A1 (0.41) | EPHX2ALDH1A1MEN1KMT2ACYP3A4 |
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-4180434-A1 | PB2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF | Sichuan Haisco Pharmaceutical Co., Ltd. (CN) | 2023-05-17 | — | — | EP | disclosed |
| WO-2022007966-A1 | PB2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 四川海思科制药有限公司 | 2022-01-13 | — | — | WO | disclosed |