Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 4/20 | 0.42 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.39 |
| ▸ | GSK3B | P49841 | 3/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.38 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3692393 | 0.88 | TP53 (0.43) | DYRK1AMAP3K11MAP4K4CSNK1DMAPK11 | |
| SCHEMBL13604952 | 0.87 | NPSR1 (0.43) | DYRK1ANPSR1MAP3K11GSK3BCSNK1D | |
| SCHEMBL27711112 | 0.87 | NPSR1 (0.46) | DYRK1ANPSR1MAP3K11GSK3BCSNK1D | |
| SCHEMBL3698984 | 0.83 | OPRM1 (0.48) | — | |
| SCHEMBL3693392 | 0.82 | OPRM1 (0.43) | CDK8 | |
| SCHEMBL13604748 | 0.82 | OPRM1 (0.51) | — | |
| SCHEMBL13604953 | 0.78 | KDM4E (0.48) | DYRK1ANPSR1MAP3K11GSK3B | |
| SCHEMBL3693110 | 0.77 | DYRK1A (0.44) | DYRK1AMAP3K11CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL3695933 | 0.76 | CACNA2D1 (0.38) | CDK8 | |
| SCHEMBL6729935 | 0.76 | FASN (0.40) | DYRK1AMAP3K11CSNK1DMAPK11MAPK14 |
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-101242819-A | Hypnotics and combinations of substituted biaryl and heteroaryl compounds and therapeutic uses thereof | AVENTIS PHARMA INC (US) | 2008-08-13 | — | — | CN | disclosed |