Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ERN1 | O75460 | 2/20 | 0.32 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.31 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20548174 | 0.80 | ADRA1A (0.40) | ADRA1ADYRK1AALDH1A1CYP1A2HPGD | |
| SCHEMBL19859646 | 0.80 | KCNJ1 (0.46) | KCNJ1DYRK1AALDH1A1L3MBTL1KDM4E | |
| SCHEMBL20304861 | 0.78 | KCNJ1 (0.45) | KCNJ1GRM5DYRK1AALDH1A1CYP1A2 | |
| SCHEMBL24018499 | 0.76 | GRIN2D (0.44) | ADRA1ADYRK1AALDH1A1CYP1A2HPGD | |
| SCHEMBL21841807 | 0.76 | AKR1C3 (0.47) | ADRA1AGRM5BTKDYRK1AALDH1A1 | |
| SCHEMBL3385593 | 0.76 | GRIN2D (0.44) | ADRA1AGRM5BTKDYRK1AALDH1A1 | |
| SCHEMBL1124372 | 0.76 | ALDH1A1 (0.55) | ALDH1A1CYP1A2HPGDCYP2C9ERN1 | |
| SCHEMBL30287647 | 0.76 | ALDH1A1 (0.55) | ALDH1A1CYP1A2HPGDCYP2C9ERN1 | |
| SCHEMBL27139164 | 0.76 | HTR3A (0.37) | ALDH1A1CYP1A2ALDH3A1ALDH1A3KDM4E | |
| SCHEMBL21292879 | 0.76 | TRIM24 (0.52) | KCNJ1ALDH1A1ALDH3A1ALDH1A3L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113166166-B | Alpha 2-adrenoreceptor subtype C (alpha-2C) antagonists for the treatment of sleep apnea | 拜耳公司 | 2024-09-10 | — | — | CN | disclosed |