Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.38 |
| ▸ | 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 |
| ▸ | EP300 | Q09472 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | CREBBP | Q92793 | 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 | |
|---|---|---|---|---|
| SCHEMBL19852940 | 0.92 | GRIN2B (0.38) | GRIN2BGRIN2CLMNACA12CA1 | |
| SCHEMBL19852944 | 0.91 | GRIN2B (0.38) | GRIN2BGRIN2CLMNACA12CA1 | |
| SCHEMBL19852943 | 0.85 | GRIN2B (0.53) | GRIN2BGRIN2C | |
| SCHEMBL19852815 | 0.84 | GRIN2B (0.38) | GRIN2BGRIN2CLMNACA12CA1 | |
| SCHEMBL24338398 | 0.82 | GRIN2B (0.58) | GRIN2BGRIN2CLMNACA12CA1 | |
| SCHEMBL19852840 | 0.82 | GRIN2B (0.39) | GRIN2BGRIN2CLMNACA12CA1 | |
| SCHEMBL24339068 | 0.82 | GRIN2B (0.39) | GRIN2BGRIN2CLMNACA12CA1 | |
| SCHEMBL19852950 | 0.81 | GRIN2B (0.35) | GRIN2BGRIN2CLMNACA12CA1 | |
| SCHEMBL24338540 | 0.80 | GRIN2B (0.35) | GRIN2BGRIN2CLMNACA12CA1 | |
| SCHEMBL24338566 | 0.80 | GRIN2B (0.35) | GRIN2BGRIN2CLMNACA12CA1 |
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-2018026779-A1 | SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF | APTINYX INC. (US) | 2018-02-08 | — | — | WO | disclosed |