Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 8/20 | 0.44 |
| ▸ | RXRA | P19793 | 8/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 8/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 8/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.42 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.39 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.39 |
| ▸ | MLYCD | O95822 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28266322 | 0.85 | L3MBTL1 (0.44) | RXRAGRIN1GRIN2B | |
| SCHEMBL28266413 | 0.83 | PIM1 (0.46) | PIM1RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL28267817 | 0.81 | CYP1A2 (0.47) | NPY5R | |
| SCHEMBL31465861 | 0.75 | PDE10A (0.48) | PIM1RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL18161248 | 0.72 | ALDH1A1 (0.61) | PIM1RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL18504510 | 0.72 | PIM1 (0.46) | PIM1RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL6671149 | 0.72 | RXRA (0.41) | PIM1RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL28266377 | 0.72 | RXRA (0.47) | PIM1RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL28459519 | 0.71 | S1PR4 (0.45) | PIM1RXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL7155477 | 0.70 | KCNH2 (0.42) | PIM1RXRAGRIN1GRIN2BKCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109071488-A | Substituted 1,2,3- triazole is as NR2B- selective NMDA regulator | 詹森药业有限公司 | 2018-12-21 | — | — | CN | claimed |
| CN-109071488-A | Substituted 1,2,3- triazole is as NR2B- selective NMDA regulator | 詹森药业有限公司 | 2018-12-21 | — | — | CN | disclosed |