Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.44 |
| ▸ | NOS1 | P29475 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 5/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28803200 | 0.72 | SMN1; SMN2 (0.44) | SMN1; SMN2NOS1RAB9ANPC1ALDH1A1 | |
| SCHEMBL2373929 | 0.70 | NOS1 (0.53) | SMN1; SMN2NOS1RAB9ANPC1ALDH1A1 | |
| SCHEMBL11165094 | 0.70 | NOS1 (0.53) | SMN1; SMN2NOS1RAB9ANPC1ALDH1A1 | |
| SCHEMBL44477 | 0.69 | NOS1 (0.51) | SMN1; SMN2NOS1RAB9ANPC1ALDH1A1 | |
| SCHEMBL19287300 | 0.69 | NOS1 (0.51) | SMN1; SMN2NOS1RAB9ANPC1ALDH1A1 | |
| SCHEMBL1518214 | 0.68 | NOS1 (0.55) | SMN1; SMN2NOS1RAB9ANPC1ALDH1A1 | |
| SCHEMBL2936392 | 0.68 | KMT2A (0.46) | SMN1; SMN2ALDH1A1ATMMAPTLMNA | |
| SCHEMBL14643881 | 0.67 | NOS1 (0.50) | SMN1; SMN2NOS1RAB9ANPC1ALDH1A1 | |
| SCHEMBL9729165 | 0.67 | NOS1 (0.50) | SMN1; SMN2NOS1RAB9ANPC1ALDH1A1 | |
| SCHEMBL11588307 | 0.67 | NOS1 (0.50) | SMN1; SMN2NOS1RAB9ANPC1ALDH1A1 |
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-114805334-B | QC and GSK-3 beta multi-targeting inhibitor and preparation method and application thereof | 深圳大学 | 2023-06-09 | — | — | CN | disclosed |
| CN-114805334-A | QC and GSK-3 beta multi-target inhibitor and preparation method and application thereof | 深圳大学 | 2022-07-29 | — | — | CN | disclosed |