Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | GALR2 | O43603 | 1/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | CCR6 | P51684 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30276192 | 0.89 | THRB (0.40) | ALDH1A1THRBGAASMN1; SMN2MAPT | |
| SCHEMBL26110877 | 0.89 | THRB (0.40) | ALDH1A1THRBGAASMN1; SMN2MAPT | |
| SCHEMBL20595604 | 0.84 | LMNA (0.37) | ALDH1A1THRBGAASMN1; SMN2MAPT | |
| SCHEMBL10378509 | 0.81 | MEN1 (0.40) | ALDH1A1THRBGAASMN1; SMN2MAPT | |
| SCHEMBL29175539 | 0.79 | SMN1; SMN2 (0.36) | GAASMN1; SMN2MAPTKMT2AMAPK1 | |
| SCHEMBL28813055 | 0.77 | ALDH1A1 (0.35) | ALDH1A1THRBGAASMN1; SMN2MAPT | |
| SCHEMBL2124914 | 0.76 | CYP2C19 (0.44) | ALDH1A1GAASMN1; SMN2MAPTKMT2A | |
| SCHEMBL16923784 | 0.76 | CYP2C19 (0.50) | ALDH1A1GAASMN1; SMN2MAPTKMT2A | |
| SCHEMBL14108033 | 0.75 | MAPT (0.40) | ALDH1A1GAASMN1; SMN2MAPTMAPK1 | |
| SCHEMBL30468543 | 0.75 | ALDH1A1 (0.47) | ALDH1A1GAASMN1; SMN2MAPTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-114853730-B | Compounds used as HPK1 kinase inhibitor, preparation method and application thereof | 中国药科大学 | 2024-03-26 | — | — | CN | disclosed |
| CN-114853730-A | Compound used as HPK1 kinase inhibitor and preparation method and application thereof | 中国药科大学 | 2022-08-05 | — | — | CN | disclosed |