Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 5/20 | 0.69 |
| ▸ | GABRB2 | P47870 | 5/20 | 0.69 |
| ▸ | GABRP | O00591 | 4/20 | 0.69 |
| ▸ | GABRD | O14764 | 4/20 | 0.69 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.69 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.69 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.69 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.69 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.69 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.69 |
| ▸ | GABRA4 | P48169 | 4/20 | 0.69 |
| ▸ | GABRE | P78334 | 4/20 | 0.69 |
| ▸ | GABRA6 | Q16445 | 4/20 | 0.69 |
| ▸ | GABRG1 | Q8N1C3 | 4/20 | 0.69 |
| ▸ | GABRG3 | Q99928 | 4/20 | 0.69 |
| ▸ | GABRQ | Q9UN88 | 4/20 | 0.69 |
| ▸ | AKR1B10 | O60218 | 3/20 | 0.69 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.69 |
| ▸ | G6PD | P11413 | 2/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.69 |
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 | |
|---|---|---|---|---|
| SCHEMBL12178194 | 1.00 | GABRA1 (0.69) | GABRA1GABRB2GABRPGABRDGABRB1 | |
| SCHEMBL13012758 | 1.00 | GABRA1 (0.69) | GABRA1GABRB2GABRPGABRDGABRB1 | |
| SCHEMBL7300704 | 1.00 | GABRA1 (0.69) | GABRA1GABRB2GABRPGABRDGABRB1 | |
| SCHEMBL18610325 | 1.00 | GABRA1 (0.69) | GABRA1GABRB2GABRPGABRDGABRB1 | |
| SCHEMBL22451788 | 1.00 | GABRA1 (0.69) | GABRA1GABRB2GABRPGABRDGABRB1 | |
| SCHEMBL23872369 | 1.00 | GABRA1 (0.69) | GABRA1GABRB2GABRPGABRDGABRB1 | |
| SCHEMBL598324 | 1.00 | GABRA1 (0.69) | GABRA1GABRB2GABRPGABRDGABRB1 | |
| SCHEMBL10308278 | 1.00 | GABRA1 (0.69) | GABRA1GABRB2GABRPGABRDGABRB1 | |
| SCHEMBL3049001 | 1.00 | GABRA1 (0.69) | GABRA1GABRB2GABRPGABRDGABRB1 | |
| SCHEMBL598323 | 1.00 | GABRA1 (0.69) | GABRA1GABRB2GABRPGABRDGABRB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009142594-A1 | THE USE OF 3BETA-ETHENYL, METHYL, 3ALPHA-HYDROXY-STEROIDS FOR THE TREATMENT OF CNS DISORDERS | UMECRINE AB (SE) | 2009-11-26 | — | — | WO | disclosed |