Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 2/20 | 0.52 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.52 |
| ▸ | RXFP1 | Q9HBX9 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.40 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.40 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL8092460 | 0.82 | GRIN1 (0.55) | GRIN1GRIN2ARXFP1KDM4EALDH1A1 | |
| SCHEMBL16270663 | 0.79 | NPC1 (0.53) | KDM4EALDH1A1POLBSMN1; SMN2MAPT | |
| SCHEMBL8100231 | 0.79 | GRIN1 (0.49) | GRIN1GRIN2ARXFP1KDM4EALDH1A1 | |
| SCHEMBL30690325 | 0.79 | ADORA2A (0.37) | GRIN1GRIN2AALDH1A1MAPTRAB9A | |
| SCHEMBL15176301 | 0.77 | CYP11B1 (0.48) | GRIN1GRIN2ARXFP1KDM4EALDH1A1 | |
| SCHEMBL32688213 | 0.77 | GRIN1 (0.48) | GRIN1GRIN2ARXFP1KDM4EALDH1A1 | |
| SCHEMBL30690315 | 0.76 | DHODH (0.39) | GRIN1GRIN2ARXFP1MAPTRAB9A | |
| SCHEMBL8102213 | 0.76 | RAD51 (0.56) | GRIN1GRIN2ARXFP1KDM4EALDH1A1 | |
| SCHEMBL32688343 | 0.75 | DCTPP1 (0.48) | GRIN1GRIN2ARXFP1KDM4EALDH1A1 | |
| SCHEMBL7920187 | 0.75 | DCTPP1 (0.48) | GRIN1GRIN2ARXFP1KDM4EALDH1A1 |
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-2024008122-A1 | PI3K INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF | 海创药业股份有限公司 | 2024-01-11 | — | — | WO | disclosed |