Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | XDH | P47989 | 1/20 | 0.50 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | PARP1 | P09874 | 4/20 | 0.45 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.43 |
| ▸ | KDM2B | Q8NHM5 | 3/20 | 0.41 |
| ▸ | IKBKB | O14920 | 2/20 | 0.40 |
| ▸ | CHUK | O15111 | 1/20 | 0.40 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.40 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL756422 | 0.85 | XDH (0.62) | KDM4EALDH1A1CA1CA2XDH | |
| SCHEMBL758397 | 0.83 | CA1 (0.56) | KDM4EALDH1A1GAACA1CA2 | |
| SCHEMBL4150121 | 0.83 | CA1 (0.51) | KDM4EALDH1A1CA1CA2XDH | |
| SCHEMBL2483533 | 0.80 | KDM4E (0.52) | KDM4EALDH1A1CA1CA2XDH | |
| SCHEMBL8797558 | 0.75 | CDC25B (0.60) | KDM4EALDH1A1GAAHTTPARP1 | |
| SCHEMBL7518100 | 0.75 | KDM4E (0.55) | KDM4EALDH1A1GAAHTTPARP1 | |
| SCHEMBL27668833 | 0.74 | KDM4E (0.67) | KDM4EALDH1A1GAAHTTIRAK4 | |
| SCHEMBL30350972 | 0.74 | KDM4E (0.67) | KDM4EALDH1A1GAAHTTIRAK4 | |
| SCHEMBL7304752 | 0.74 | CA1 (0.61) | KDM4EALDH1A1CA1CA2XDH | |
| SCHEMBL17919939 | 0.74 | KDM4E (0.53) | KDM4EALDH1A1GAAHTTIRAK4 |
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-4249480-A1 | DIPHENYLPYRAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | Northwest A&F University (CN) | 2023-09-27 | — | — | EP | disclosed |
| CN-112384495-B | Novel modulators of metabotropic and ion-channel transmembrane receptors and uses thereof | IBD治疗学有限责任公司 | 2023-07-18 | — | — | CN | disclosed |