Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA5 | P31644 | 3/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.37 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.37 |
| ▸ | GABRP | O00591 | 1/20 | 0.37 |
| ▸ | GABRD | O14764 | 1/20 | 0.37 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.37 |
| ▸ | GABRE | P78334 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.37 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.37 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.37 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.37 |
| ▸ | SLC6A1 | P30531 | 4/20 | 0.36 |
| ▸ | SLC6A11 | P48066 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28596130 | 1.00 | GABRA5 (0.37) | GABRA5GABRB2TSHRGABRA1GABRA4 | |
| SCHEMBL23418816 | 0.94 | GABRA5 (0.45) | GABRA5GABRB2TSHRGABRA1GABRA4 | |
| SCHEMBL22445486 | 0.87 | GABRA1 (0.44) | GABRA5GABRB2TSHRGABRA1GABRA4 | |
| SCHEMBL23407873 | 0.84 | SCN1A (0.35) | MAPTKMT2A | |
| SCHEMBL9346315 | 0.83 | GABRA1 (0.50) | GABRA5GABRB2TSHRGABRA1GABRA4 | |
| SCHEMBL14810067 | 0.78 | GABRA1 (0.50) | GABRA5GABRB2TSHRGABRA1GABRA4 | |
| SCHEMBL5269743 | 0.78 | — | — | |
| SCHEMBL23906197 | 0.78 | SLC6A1 (0.34) | GABRA5GABRB2GABRA1GABRA4SLC6A1 | |
| SCHEMBL15082410 | 0.78 | CHRM3 (0.44) | GABRA5GABRB2TSHRGABRA1GABRA4 | |
| Hydrochloric Acid SCHEMBL29098542 | 0.78 | TSHR (0.40) | GABRA5GABRB2TSHRGABRA1GABRA4 |
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-113149972-B | 2- (aryl (azacycloalkane-1-yl) methyl) phenol derivatives and use thereof | 四川大学 | 2022-09-13 | — | — | CN | disclosed |
| CN-113149972-A | 2- (aryl (azacycloalkane-1-yl) methyl) phenol derivatives and use thereof | 四川大学 | 2021-07-23 | — | — | CN | disclosed |