Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.60 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.49 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.49 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.49 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.49 |
| ▸ | ABCC9 | O60706 | 2/20 | 0.49 |
| ▸ | ABCC8 | Q09428 | 2/20 | 0.49 |
| ▸ | KCNJ11 | Q14654 | 2/20 | 0.49 |
| ▸ | KCNJ8 | Q15842 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11935683 | 0.86 | ALDH1A1 (0.53) | ALDH1A1LMNAGAAHTTMAPK1 | |
| SCHEMBL17090472 | 0.83 | ALDH1A1 (0.60) | ALDH1A1USP2TSHRHSD17B10MAPK1 | |
| SCHEMBL10115262 | 0.83 | ALDH1A1 (0.61) | ALDH1A1PDK1PDK2PDK3PDK4 | |
| SCHEMBL13564869 | 0.83 | MAPT (0.43) | ALDH1A1LMNAGAAHTTTSHR | |
| SCHEMBL17090266 | 0.82 | SMN1; SMN2 (0.45) | ALDH1A1LMNAGAAUSP2HTT | |
| SCHEMBL13565245 | 0.82 | SMN1; SMN2 (0.45) | ALDH1A1LMNAGAAUSP2HTT | |
| SCHEMBL13565486 | 0.81 | MAPT (0.44) | ALDH1A1LMNAGAAHTTTSHR | |
| SCHEMBL11935690 | 0.81 | ALDH1A1 (0.67) | ALDH1A1LMNAUSP2HTTTSHR | |
| SCHEMBL11934919 | 0.80 | MAPT (0.41) | ALDH1A1LMNAGAAHTTTSHR | |
| SCHEMBL13565521 | 0.77 | ALDH1A1 (0.52) | ALDH1A1LMNAGAAHTTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |