Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.38 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 5/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | GABRE | P78334 | 1/20 | 0.35 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21596480 | 0.84 | OPRK1 (0.39) | ATRAAK1POLBRORCALDH1A1 | |
| SCHEMBL18044633 | 0.83 | AAK1 (0.38) | AAK1ALDH1A1OPRK1GABRA1GABRG2 | |
| SCHEMBL733159 | 0.82 | OPRK1 (0.49) | OPRK1 | |
| SCHEMBL28528395 | 0.81 | GABRG2 (0.41) | ATRPOLBALDH1A1OPRK1GABRA1 | |
| SCHEMBL3540698 | 0.80 | AAK1 (0.41) | AAK1ALDH1A1OPRK1GABRA1GABRG2 | |
| SCHEMBL17315745 | 0.79 | ATR (0.36) | ATRPOLBALDH1A1GABRA1GABRG2 | |
| SCHEMBL28621778 | 0.79 | ALDH1A1 (0.35) | POLBALDH1A1OPRK1 | |
| SCHEMBL10324630 | 0.78 | CNR1 (0.38) | ATRAAK1POLBALDH1A1GABRA1 | |
| SCHEMBL28535766 | 0.78 | OPRK1 (0.48) | POLBALDH1A1OPRK1GABRA1GABRG2 | |
| SCHEMBL16077093 | 0.78 | OPRK1 (0.40) | OPRK1 |
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-112334457-A | Process for preparing tricyclic compounds | 拜耳公司 | 2021-02-05 | — | — | CN | disclosed |