Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.51 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.51 |
| ▸ | GRIN1 | Q05586 | 11/20 | 0.51 |
| ▸ | GRIN2B | Q13224 | 11/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CNOT7 | Q9UIV1 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | RGS12 | O14924 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.45 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17807874 | 0.86 | GRIN1 (0.52) | GRIN1GRIN2B | |
| SCHEMBL15999458 | 0.77 | PDE4A (0.44) | GRIN1GRIN2BKMT2AMEN1PRKCQ | |
| SCHEMBL20134012 | 0.77 | GRIN1 (0.58) | GRIN1GRIN2B | |
| SCHEMBL31008703 | 0.77 | GRIN1 (0.58) | GRIN1GRIN2B | |
| SCHEMBL28829341 | 0.76 | ADORA3 (0.51) | ADORA3ADORA2BKMT2AL3MBTL1CNOT7 | |
| SCHEMBL22516697 | 0.76 | GRIN1 (0.56) | GRIN1GRIN2B | |
| SCHEMBL1564239 | 0.74 | GRIN1 (0.55) | GRIN1GRIN2B | |
| SCHEMBL1564343 | 0.74 | GRIN1 (0.55) | GRIN1GRIN2B | |
| SCHEMBL1563878 | 0.74 | GRIN1 (0.38) | GRIN1GRIN2B | |
| SCHEMBL20874771 | 0.74 | GRIN1 (0.56) | GRIN1GRIN2B |
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-105693730-A | Heteroaryl compounds, compositions thereof, and their use as protein kinase inhibitors | 西格诺药品有限公司 | 2016-06-22 | — | — | CN | disclosed |