Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | AXL | P30530 | 1/20 | 0.35 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.34 |
| ▸ | ATP4A | P20648 | 3/20 | 0.33 |
| ▸ | ATP4B | P51164 | 3/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.32 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8816087 | 0.84 | ALDH1A1 (0.33) | ALDH1A1MAPTKMT2ALMNA | |
| SCHEMBL12809663 | 0.81 | ATP4A (0.38) | ALDH1A1CYP1A2CYP2C19MAPTMEN1 | |
| SCHEMBL8815466 | 0.81 | ALDH1A1 (0.38) | ALDH1A1CYP1A2CYP2C19MAPTMEN1 | |
| SCHEMBL10701669 | 0.81 | ALDH1A1 (0.34) | ALDH1A1CYP1A2CYP2C19MAPTMEN1 | |
| SCHEMBL6475880 | 0.81 | ATP4A (0.49) | ALDH1A1CYP1A2CYP2C19MAPTMEN1 | |
| SCHEMBL3917830 | 0.80 | ATP4A (0.42) | ALDH1A1CYP1A2CYP2C19MAPTMEN1 | |
| SCHEMBL6474148 | 0.80 | ATP4A (0.47) | ALDH1A1CYP1A2CYP2C19MAPTMEN1 | |
| SCHEMBL6475624 | 0.79 | ATP4A (0.48) | ALDH1A1CYP1A2CYP2C19MAPTMEN1 | |
| SCHEMBL19987364 | 0.79 | AMY1A (0.37) | ALDH1A1CYP1A2CYP2C19MAPTMEN1 | |
| SCHEMBL6481712 | 0.79 | CYP1A2 (0.35) | ALDH1A1CYP1A2CYP2C19MAPTMEN1 |
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-1997000875-A1 | BENZIMIDAZOLE DERIVATIVES CONTAINING FUSED PYRIDINE | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 1997-01-09 | — | — | WO | disclosed |