Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | NQO2 | P16083 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ERN1 | O75460 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | NQO1 | P15559 | 1/20 | 0.39 |
| ▸ | PTGES | O14684 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.37 |
| ▸ | TUBB | P07437 | 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 | |
|---|---|---|---|---|
| SCHEMBL3263989 | 1.00 | ALDH1A1 (0.54) | ALDH1A1KDM4ENPSR1HPGDMAPK1 | |
| SCHEMBL16222420 | 0.92 | ALDH1A1 (0.48) | ALDH1A1KDM4ENPSR1HPGDMAPK1 | |
| SCHEMBL27905184 | 0.89 | MAPT (0.67) | ALDH1A1KDM4ENPSR1HPGDSMN1; SMN2 | |
| SCHEMBL14314326 | 0.89 | KDM4E (0.46) | ALDH1A1KDM4ENPSR1HPGDMAPK1 | |
| SCHEMBL14297112 | 0.89 | ALDH1A1 (0.46) | ALDH1A1KDM4ENPSR1HPGDMAPK1 | |
| SCHEMBL16219585 | 0.87 | ALDH1A1 (0.44) | ALDH1A1KDM4ENPSR1HPGDMAPK1 | |
| SCHEMBL29227832 | 0.86 | ALDH1A1 (0.48) | ALDH1A1KDM4ENPSR1HPGDMAPK1 | |
| SCHEMBL32677758 | 0.83 | ALDH1A1 (0.45) | ALDH1A1KDM4ENPSR1HPGDMAPK1 | |
| SCHEMBL31326850 | 0.81 | NQO2 (0.44) | ALDH1A1KDM4ENPSR1HPGDMAPK1 | |
| SCHEMBL3920626 | 0.81 | ALDH1A1 (0.41) | ALDH1A1KDM4ENPSR1HPGDMAPK1 |
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-109734747-B | Chiral iminodiphosphate and derivatives thereof | 科勒研究有限公司 | 2024-08-27 | — | — | CN | disclosed |