Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRP | O00591 | 4/20 | 0.45 |
| ▸ | GABRD | O14764 | 4/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.45 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.45 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.45 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.45 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.45 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.45 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.45 |
| ▸ | GABRA4 | P48169 | 4/20 | 0.45 |
| ▸ | GABRE | P78334 | 4/20 | 0.45 |
| ▸ | GABRA6 | Q16445 | 4/20 | 0.45 |
| ▸ | GABRG1 | Q8N1C3 | 4/20 | 0.45 |
| ▸ | GABRG3 | Q99928 | 4/20 | 0.45 |
| ▸ | GABRQ | Q9UN88 | 4/20 | 0.45 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10713526 | 0.86 | GABRP (0.42) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Cyclohexanone Oxime SCHEMBL27858767 | 0.83 | TSHR (0.56) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL10782109 | 0.77 | — | — | |
| SCHEMBL10712733 | 0.75 | — | — | |
| SCHEMBL10712148 | 0.74 | TSHR (0.39) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL708881 | 0.74 | GABRP (0.41) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Bicarbonate SCHEMBL11025592 | 0.73 | — | — | |
| SCHEMBL6126 | 0.72 | GABRP (0.46) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL27041262 | 0.72 | GABRP (0.46) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL7679397 | 0.71 | ALDH1A1 (0.47) | GABRA1GABRA5GABRB2GABRA4GABRR1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4362743-A | BACTERICIDE, FUNGICIDE | BEECHAM GROUP LIMITED (GB) | 1982-12-07 | — | — | US | claimed |
| EP-0046031-A1 | Antibacterial compounds, processes for their preparation and compositions containing them | BEECHAM GROUP PLC (GB) | 1982-02-17 | — | — | EP | claimed |
| CN-1756740-A | Nitrogen-containing heterocyclic derivatives having 2, 6-disubstituted styryl group | ASTELLAS PHARMA INC (JP) | 2006-04-05 | — | — | CN | disclosed |
| US-4362743-A | BACTERICIDE, FUNGICIDE | BEECHAM GROUP LIMITED (GB) | 1982-12-07 | — | — | US | disclosed |
| EP-0046031-A1 | Antibacterial compounds, processes for their preparation and compositions containing them | BEECHAM GROUP PLC (GB) | 1982-02-17 | — | — | EP | disclosed |
| US-3931288-A | ANTIINFLAMMATORY, ANTIRHEUMATIC | HOFFMANN-LA ROCHE INC. (US) | 1976-01-06 | — | — | US | disclosed |