Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SYK | P43405 | 4/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4687077 | 0.79 | NPC1 (0.46) | ALDH1A1SYKBRD4KDM4ERAB9A | |
| SCHEMBL14546939 | 0.79 | ALDH1A1 (0.43) | ALDH1A1SYKBRD4 | |
| SCHEMBL24655829 | 0.78 | SYK (0.41) | ALDH1A1SYK | |
| SCHEMBL19454658 | 0.78 | ALDH1A1 (0.41) | ALDH1A1SYKBRD4KDM4ERAB9A | |
| SCHEMBL7899279 | 0.77 | GAA (0.42) | ALDH1A1KDM4ECDK1MEN1GAA | |
| SCHEMBL13733509 | 0.76 | HRH3 (0.47) | SYKHRH3GAAHRH4 | |
| SCHEMBL3524349 | 0.76 | ALDH1A1 (0.76) | ALDH1A1HRH3HPGDCHRNB2CHRNA4 | |
| SCHEMBL20341674 | 0.75 | KMT2A (0.45) | ALDH1A1KDM4ERAB9ANPC1MEN1 | |
| SCHEMBL22153394 | 0.75 | HRH3 (0.42) | ALDH1A1HRH3HPGDSMN1; SMN2HRH4 | |
| SCHEMBL13191670 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022234271-A1 | HETEROARYL COMPOUNDS USEFUL IN THE TREATMENT OF COGNITIVE DISORDERS | UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) | 2022-11-10 | — | — | WO | disclosed |