Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | MARK3 | P27448 | 1/20 | 0.32 |
| ▸ | GSK3A | P49840 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.31 |
| ▸ | STK10 | O94804 | 1/20 | 0.31 |
| ▸ | SLK | Q9H2G2 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 2/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | ALDH1A3 | P47895 | 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 | |
|---|---|---|---|---|
| SCHEMBL21159977 | 0.87 | NPC1 (0.46) | NPC1RAB9APAX8GABRA1GABRG2 | |
| SCHEMBL21160261 | 0.86 | NPC1 (0.44) | NPC1RAB9APAX8KDM1AMAOB | |
| SCHEMBL23099293 | 0.84 | P2RX7 (0.32) | P2RX7 | |
| SCHEMBL18697604 | 0.83 | P2RX7 (0.33) | P2RX7 | |
| SCHEMBL21160342 | 0.83 | NPC1 (0.38) | NPC1RAB9ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL24747165 | 0.82 | NPC1 (0.41) | NPC1RAB9ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL21160198 | 0.82 | NPC1 (0.39) | NPC1RAB9ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL18818876 | 0.81 | NPC1 (0.44) | NPC1RAB9APAX8GABRA1GABRG2 | |
| SCHEMBL24747326 | 0.81 | NPC1 (0.43) | NPC1RAB9ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL22056435 | 0.81 | NPC1 (0.42) | NPC1RAB9ASLC6A2SLC6A4SLC6A3 |
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-2021135725-A1 | ORGANIC COMPOUND, ELECTRONIC DEVICE AND ELECTRONIC APPARATUS USING SAME | 陕西莱特光电材料股份有限公司 | 2021-07-08 | — | — | WO | disclosed |