Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 17/20 | 0.54 |
| ▸ | GRIN1 | Q05586 | 17/20 | 0.54 |
| ▸ | GRIN2B | Q13224 | 17/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28267947 | 0.82 | RXRA (0.62) | RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL28267951 | 0.80 | RXRA (0.64) | RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL28609240 | 0.78 | RXRA (0.66) | RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL19211349 | 0.75 | RXRA (0.63) | RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL19211430 | 0.75 | NOTUM (0.76) | RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL16787394 | 0.74 | NOTUM (0.58) | RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL15883335 | 0.74 | CA2 (0.57) | RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL22185935 | 0.73 | RXRA (0.39) | RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL15883329 | 0.72 | MIF (0.61) | RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL19232884 | 0.72 | RXRA (0.47) | RXRAGRIN1GRIN2BKCNH2 |
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-109071488-B | Substituted 1,2, 3-triazoles as NR 2B-selective NMDA modulators | 詹森药业有限公司 | 2021-08-13 | — | — | CN | disclosed |