Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.64 |
| ▸ | HPGD | P15428 | 3/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | RECQL | P46063 | 1/20 | 0.62 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL27580597 | 0.86 | ALDH1A1 (0.82) | ALDH1A1SMN1; SMN2KDM4EHSD17B10HPGD | |
| SCHEMBL1459007 | 0.85 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2KDM4EHSD17B10HPGD | |
| SCHEMBL595054 | 0.83 | ALDH1A1 (0.66) | ALDH1A1SMN1; SMN2KDM4EHSD17B10HPGD | |
| SCHEMBL4550239 | 0.83 | ALDH1A1 (0.76) | ALDH1A1SMN1; SMN2KDM4EHSD17B10HPGD | |
| SCHEMBL5714681 | 0.83 | ALDH1A1 (0.70) | ALDH1A1SMN1; SMN2KDM4EHSD17B10HPGD | |
| SCHEMBL1270156 | 0.83 | ALDH1A1 (0.66) | ALDH1A1SMN1; SMN2KDM4EHSD17B10HPGD | |
| SCHEMBL6826586 | 0.83 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2KDM4EHSD17B10HPGD | |
| SCHEMBL14562620 | 0.82 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2KDM4EHSD17B10HPGD | |
| SCHEMBL15800694 | 0.82 | PLD1 (0.73) | ALDH1A1SMN1; SMN2KDM4EHSD17B10HPGD | |
| SCHEMBL21353591 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0552417-A1 | Cyclic peptides and use thereof | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1993-07-28 | — | — | EP | disclosed |
| EP-0528312-A2 | Cyclic peptides and use thereof | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1993-02-24 | — | — | EP | disclosed |