Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 10/20 | 0.48 |
| ▸ | GABRG2 | P18507 | 10/20 | 0.48 |
| ▸ | GABRB3 | P28472 | 10/20 | 0.48 |
| ▸ | GABRA5 | P31644 | 10/20 | 0.48 |
| ▸ | GABRA3 | P34903 | 10/20 | 0.48 |
| ▸ | GABRA2 | P47869 | 10/20 | 0.48 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.48 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.43 |
| ▸ | EGLN1 | Q9GZT9 | 5/20 | 0.40 |
| ▸ | TYK2 | P29597 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21362575 | 0.93 | GABRA1 (0.49) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL26014523 | 0.93 | GABRA1 (0.49) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL21362574 | 0.89 | GABRA5 (0.54) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL18973253 | 0.88 | GABRA5 (0.46) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL21362651 | 0.88 | GABRA5 (0.52) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL26016232 | 0.88 | GABRA1 (0.53) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL21362478 | 0.88 | GABRA5 (0.53) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL21362682 | 0.88 | GABRA5 (0.53) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL21362598 | 0.88 | GABRA5 (0.53) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL21362652 | 0.88 | GABRA5 (0.53) | GABRA1GABRG2GABRB3GABRA5GABRA3 |
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-2019174577-A1 | PHTHALAZINE ISOXAZOLE ALKOXY DERIVATIVES, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND USE THEREOF | 上海赛默罗生物科技有限公司 | 2019-09-19 | — | — | WO | disclosed |