Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 12/20 | 0.38 |
| ▸ | MTOR | P42345 | 8/20 | 0.38 |
| ▸ | ERN1 | O75460 | 2/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.31 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.31 |
| ▸ | ITK | Q08881 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27807944 | 0.89 | AKT1 (0.30) | MTORAKT1 | |
| SCHEMBL27785925 | 0.86 | GABRA2 (0.36) | PIK3CAMTORGABRG2GABRB3GABRA2 | |
| SCHEMBL27807948 | 0.85 | GABRG2 (0.49) | GABRG2GABRB3GABRA2 | |
| SCHEMBL27807946 | 0.84 | — | — | |
| SCHEMBL27807904 | 0.83 | PIK3CA (0.42) | PIK3CAMTORAKT1 | |
| SCHEMBL27785971 | 0.83 | GABRG2 (0.33) | PIK3CAGABRG2GABRB3GABRA2 | |
| SCHEMBL27807957 | 0.83 | GABRG2 (0.36) | PIK3CAGABRG2GABRB3GABRA2 | |
| SCHEMBL27786205 | 0.82 | GABRG2 (0.34) | GABRG2GABRB3GABRA2 | |
| SCHEMBL27786174 | 0.82 | GABRG2 (0.50) | GABRG2GABRB3GABRA2 | |
| SCHEMBL27808006 | 0.81 | PIK3CA (0.37) | PIK3CAMTORGABRG2GABRB3GABRA2 |
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-101778849-A | Fused quinoline derivatives useful as gaba modulators | ASTRAZENECA AB | 2010-07-14 | — | — | CN | disclosed |