Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.52 |
| ▸ | HPGD | P15428 | 6/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11339548 | 0.79 | ALDH1A1 (0.63) | ALDH1A1HPGDGAATP53SMN1; SMN2 | |
| SCHEMBL27870679 | 0.74 | RAB9A (0.49) | ALDH1A1HPGDSMN1; SMN2USP2POLB | |
| SCHEMBL10917121 | 0.72 | ALDH1A1 (0.56) | ALDH1A1HPGDGAATP53SMN1; SMN2 | |
| SCHEMBL6853606 | 0.72 | ALDH1A1 (0.56) | ALDH1A1HPGDGAATP53SMN1; SMN2 | |
| SCHEMBL13915547 | 0.72 | ALDH1A1 (0.73) | ALDH1A1HPGDGAATP53SMN1; SMN2 | |
| SCHEMBL4170765 | 0.72 | ALDH1A1 (0.73) | ALDH1A1HPGDGAATP53SMN1; SMN2 | |
| SCHEMBL4170764 | 0.72 | ALDH1A1 (0.73) | ALDH1A1HPGDGAATP53SMN1; SMN2 | |
| SCHEMBL27278934 | 0.72 | POLB (0.62) | ALDH1A1HPGDTP53SMN1; SMN2HSD17B10 | |
| SCHEMBL23877938 | 0.72 | MAPT (0.47) | ALDH1A1HPGDGAATP53SMN1; SMN2 | |
| SCHEMBL8633653 | 0.71 | MMP1 (0.42) | ALDH1A1HPGDGAAHTTPOLB |
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-101646678-B | heteroaryl derivatives | NIPPON SHINYAKU CO LTD | 2012-05-30 | — | — | CN | disclosed |