Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.30 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.30 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.30 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.30 |
| ▸ | GABRA2 | P47869 | 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 | |
|---|---|---|---|---|
| SCHEMBL18280680 | 0.84 | — | — | |
| SCHEMBL18289265 | 0.80 | GABRG2 (0.32) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL18280674 | 0.79 | GABRA1 (0.31) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL18280681 | 0.78 | KDM4E (0.31) | GABRA1GABRG2GABRB3GABRA2 | |
| SCHEMBL28098712 | 0.76 | — | — | |
| SCHEMBL18280678 | 0.74 | — | — | |
| SCHEMBL4524277 | 0.70 | AKR1C3 (0.43) | — | |
| SCHEMBL18289274 | 0.70 | — | — | |
| SCHEMBL17080368 | 0.67 | PRKAB2 (0.42) | — | |
| SCHEMBL18289228 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105960402-A | Microbicidal heterobicyclic derivatives | 先正达参股股份有限公司 | 2016-09-21 | — | — | CN | disclosed |