Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.56 |
| ▸ | CA9 | Q16790 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | NQO1 | P15559 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.51 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.51 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL17169389 | 0.88 | CA12 (0.69) | CA12CA9KDM4EALDH1A1NQO1 | |
| SCHEMBL26335692 | 0.83 | CA12 (0.48) | CA12CA9KDM4EALDH1A1NQO1 | |
| SCHEMBL26338052 | 0.81 | CA12 (0.46) | CA12CA9KDM4EALDH1A1NQO1 | |
| SCHEMBL1648026 | 0.80 | CA12 (0.58) | CA12CA9KDM4EALDH1A1NQO1 | |
| SCHEMBL3263341 | 0.79 | CYP2C19 (0.58) | KDM4EALDH1A1CYP2C9CYP2C19HPGD | |
| SCHEMBL27543799 | 0.76 | CA12 (0.54) | CA12CA9KDM4EALDH1A1NQO1 | |
| SCHEMBL7737431 | 0.74 | KDM4E (0.69) | CA12CA9KDM4EALDH1A1NQO1 | |
| SCHEMBL29379994 | 0.74 | KDM4E (0.69) | CA12CA9KDM4EALDH1A1NQO1 | |
| SCHEMBL29872 | 0.74 | KDM4E (0.69) | CA12CA9KDM4EALDH1A1NQO1 | |
| SCHEMBL30153359 | 0.73 | KDM4E (0.73) | CA12CA9KDM4EALDH1A1NQO1 |
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-4249480-A1 | DIPHENYLPYRAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | Northwest A&F University (CN) | 2023-09-27 | — | — | EP | disclosed |