Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 1/20 | 0.52 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.52 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA3 | P07451 | 1/20 | 0.30 |
| ▸ | CA4 | P22748 | 1/20 | 0.30 |
| ▸ | CA6 | P23280 | 1/20 | 0.30 |
| ▸ | CA5A | P35218 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.30 |
| ▸ | CA5B | Q9Y2D0 | 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 | |
|---|---|---|---|---|
| SCHEMBL28545915 | 1.00 | GRIN2B (0.52) | GRIN2BGRIN2CJAK3DRD2LMNA | |
| SCHEMBL28545914 | 1.00 | GRIN2B (0.52) | GRIN2BGRIN2CJAK3DRD2LMNA | |
| SCHEMBL28550363 | 0.88 | GRIN2B (0.45) | GRIN2BGRIN2CJAK3 | |
| SCHEMBL28550362 | 0.88 | GRIN2B (0.45) | GRIN2BGRIN2CJAK3 | |
| SCHEMBL28550361 | 0.88 | GRIN2B (0.45) | GRIN2BGRIN2CJAK3 | |
| Nyx-2925 SCHEMBL19614447 | 0.86 | GRIN2B (0.70) | GRIN2BGRIN2CJAK3 | |
| Nyx-2925 SCHEMBL18119905 | 0.86 | GRIN2B (0.70) | GRIN2BGRIN2CJAK3 | |
| SCHEMBL22946654 | 0.86 | GRIN2B (0.49) | GRIN2BGRIN2CJAK3LMNACA12 | |
| Nyx-2925 SCHEMBL17712358 | 0.86 | GRIN2B (0.70) | GRIN2BGRIN2CJAK3 | |
| Nyx-2925 SCHEMBL19614471 | 0.86 | GRIN2B (0.70) | GRIN2BGRIN2CJAK3 |
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-112745325-A | Pyrrole spiro-butyrolactam derivative and preparation thereof | 四川海思科制药有限公司 | 2021-05-04 | — | — | CN | disclosed |