Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 10/20 | 0.38 |
| ▸ | ITGA2B | P08514 | 10/20 | 0.38 |
| ▸ | PLG | P00747 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CTSL | P07711 | 1/20 | 0.32 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21225630 | 0.91 | ITGB3 (0.40) | ITGB3ITGA2BCTSK | |
| SCHEMBL21225628 | 0.91 | ITGB3 (0.40) | ITGB3ITGA2BCTSK | |
| SCHEMBL21225293 | 0.84 | CCKBR (0.35) | — | |
| SCHEMBL21225289 | 0.84 | CCKBR (0.35) | — | |
| SCHEMBL21246541 | 0.82 | ITGB3 (0.44) | ITGB3ITGA2BCTSL | |
| Hydrochloric Acid SCHEMBL21224547 | 0.75 | ALOX15 (0.35) | — | |
| Hydrochloric Acid SCHEMBL21224546 | 0.75 | ALOX15 (0.35) | — | |
| SCHEMBL21246537 | 0.73 | ALDH1A1 (0.38) | HSD17B10 | |
| SCHEMBL6809194 | 0.72 | TSHR (0.41) | ITGB3ITGA2BCTSKCTSL | |
| SCHEMBL23845318 | 0.70 | CYP1A2 (0.45) | CTSKCTSL |
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-2019152688-A1 | SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF | APTINYX INC. (US) | 2019-08-08 | — | — | WO | disclosed |