Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRP | O00591 | 2/20 | 0.45 |
| ▸ | GABRD | O14764 | 2/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.45 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.45 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.45 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.45 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.45 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.45 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.45 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.45 |
| ▸ | GABRE | P78334 | 2/20 | 0.45 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.45 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.45 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.45 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.45 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7141671 | 0.87 | GABRP (0.54) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Azelaic Acid SCHEMBL28658176 | 0.82 | GPR84 (0.50) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL10775056 | 0.77 | CYP1A2 (0.39) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL27932597 | 0.77 | CHRNB2 (0.44) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL14071943 | 0.77 | AKR1B1 (0.44) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL2565496 | 0.77 | FDPS (0.31) | CHRNB2CHRNB4CHRNA4ALDH1A1ALOX15 | |
| Propanol SCHEMBL14742011 | 0.75 | CHRNB2 (0.56) | AKR1B1CHRNB2CHRNB4CHRNA4GPR84 | |
| Valeric Acid SCHEMBL27608601 | 0.73 | AKR1B1 (0.52) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL20780373 | 0.73 | AKR1B1 (0.46) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL103177 | 0.73 | PGR (0.39) | GPR84ALDH1A1TDP1SLC22A6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1641729-B1 | USE OF FUNCTIONALIZED ONIUM SALTS AS A SOLUBLE SUPPORT FOR ORGANIC SYNTHESIS | CENTRE NAT RECH SCIENT (FR) | 2008-05-07 | — | — | EP | disclosed |