Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRG2 | P18507 | 7/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 7/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 6/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 6/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 5/20 | 0.39 |
| ▸ | GABRA6 | Q16445 | 5/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 5/20 | 0.39 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.31 |
| ▸ | JAK1 | P23458 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | PTGES | O14684 | 2/20 | 0.30 |
| ▸ | KAT2B | Q92831 | 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 | |
|---|---|---|---|---|
| SCHEMBL12373582 | 1.00 | GABRG2 (0.39) | GABRG2GABRB3GABRA1GABRA2GABRA5 | |
| SCHEMBL12798776 | 0.91 | GABRA1 (0.39) | GABRG2GABRB3GABRA1GABRA2GABRA5 | |
| SCHEMBL19488770 | 0.89 | GABRA1 (0.42) | GABRG2GABRB3GABRA1GABRA2GABRA5 | |
| SCHEMBL12373562 | 0.89 | GABRA1 (0.42) | GABRG2GABRB3GABRA1GABRA2GABRA5 | |
| SCHEMBL12849501 | 0.87 | CHEK2 (0.35) | HCRTR1HCRTR2GPR119JAK1PARP1 | |
| SCHEMBL10201123 | 0.85 | CDK1 (0.36) | GABRG2GABRB3GABRA1GABRA2GABRA5 | |
| SCHEMBL1293357 | 0.85 | CDK1 (0.36) | GABRG2GABRB3GABRA1GABRA2GABRA5 | |
| SCHEMBL1293358 | 0.85 | CDK1 (0.36) | GABRG2GABRB3GABRA1GABRA2GABRA5 | |
| SCHEMBL10200232 | 0.85 | GABRG2 (0.35) | GABRG2GABRB3GABRA1GABRA2GABRA5 | |
| SCHEMBL12295805 | 0.85 | GABRG2 (0.35) | GABRG2GABRB3GABRA1GABRA2GABRA5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2398794-B1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2013-01-16 | — | — | EP | disclosed |
| WO-2012018325-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-02-09 | — | — | WO | disclosed |