Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B10 | O60218 | 3/20 | 0.58 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.58 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.58 |
| ▸ | GABRP | O00591 | 4/20 | 0.53 |
| ▸ | GABRD | O14764 | 4/20 | 0.53 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.53 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.53 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.53 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.53 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.53 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.53 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.53 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.53 |
| ▸ | GABRA4 | P48169 | 4/20 | 0.53 |
| ▸ | GABRE | P78334 | 4/20 | 0.53 |
| ▸ | GABRA6 | Q16445 | 4/20 | 0.53 |
| ▸ | GABRG1 | Q8N1C3 | 4/20 | 0.53 |
| ▸ | GABRG3 | Q99928 | 4/20 | 0.53 |
| ▸ | GABRQ | Q9UN88 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL19260808 | 0.86 | GRIN2D (0.57) | AKR1B10AKR1B1GPBAR1GABRPGABRD | |
| SCHEMBL7062550 | 0.86 | GRIN2D (0.57) | AKR1B10AKR1B1GPBAR1GABRPGABRD | |
| SCHEMBL8964931 | 0.86 | CYP19A1 (0.49) | AKR1B10AKR1B1GPBAR1MEN1KMT2A | |
| SCHEMBL8964927 | 0.86 | CYP19A1 (0.49) | AKR1B10AKR1B1GPBAR1MEN1KMT2A | |
| SCHEMBL9706991 | 0.85 | CYP17A1 (0.46) | AKR1B10AKR1B1GPBAR1GABRPGABRD | |
| SCHEMBL890668 | 0.84 | AKR1B10 (0.63) | AKR1B10AKR1B1GPBAR1GABRPGABRD | |
| SCHEMBL1235822 | 0.84 | AKR1B10 (0.63) | AKR1B10AKR1B1GPBAR1GABRPGABRD | |
| SCHEMBL6432078 | 0.83 | NR1I3 (0.47) | AKR1B10AKR1B1GPBAR1SRD5A2GRIN1 | |
| SCHEMBL11621001 | 0.82 | AKR1B10 (0.55) | AKR1B10AKR1B1GPBAR1GABRPGABRD | |
| SCHEMBL3361092 | 0.81 | SRD5A2 (0.40) | AKR1B10AKR1B1GPBAR1MEN1KMT2A |
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-2015134670-A1 | DEUTERATED GANAXOLONE DERIVATIVES | ZHANG MINGBAO (US) | 2015-09-11 | — | — | WO | disclosed |