Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.44 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | HPGDS | O60760 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29071720 | 0.77 | MAPT (0.46) | KDM4EHSD17B10ALDH1A1HPGDMAPK1 | |
| SCHEMBL29071713 | 0.75 | TDO2 (0.50) | KDM4EHSD17B10ALDH1A1HPGDKMT2A | |
| SCHEMBL8840880 | 0.71 | PDE4A (0.67) | KDM4EHSD17B10ALDH1A1PDE4AHPGD | |
| SCHEMBL29071714 | 0.71 | SMN1; SMN2 (0.37) | KDM4EHSD17B10ALDH1A1MAPK1MEN1 | |
| SCHEMBL29071715 | 0.69 | RAB9A (0.47) | HSD17B10ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL7140279 | 0.69 | ALDH1A1 (0.59) | KDM4EHSD17B10ALDH1A1PDE4AMEN1 | |
| SCHEMBL30610431 | 0.69 | ALDH1A1 (0.59) | KDM4EHSD17B10ALDH1A1PDE4AMEN1 | |
| SCHEMBL9566448 | 0.68 | KDM4E (0.58) | KDM4EHSD17B10ALDH1A1PDE4AMEN1 | |
| SCHEMBL7708794 | 0.68 | KDM4E (0.54) | KDM4EHSD17B10ALDH1A1PDE4AHPGD | |
| SCHEMBL8489079 | 0.68 | KDM4E (0.58) | KDM4EHSD17B10ALDH1A1PDE4AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116535356-A | 3-amino-5-phenyl-pyrazole derivative tubulin inhibitor and preparation and medical application thereof | 中国药科大学 | 2023-08-04 | — | — | CN | disclosed |