Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.38 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | JUN | P05412 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2861455 | 0.83 | KCNA5 (0.46) | KCNA5ALDH1A1CYP3A4CYP2A6CYP1A2 | |
| SCHEMBL8504493 | 0.79 | KCNA5 (0.43) | KCNA5ALDH1A1CYP3A4CYP2A6CYP1A2 | |
| SCHEMBL2646034 | 0.79 | KCNA5 (0.43) | KCNA5ALDH1A1CYP3A4CYP2A6CYP1A2 | |
| SCHEMBL10985893 | 0.79 | KCNA5 (0.43) | KCNA5ALDH1A1CYP3A4CYP2A6CYP1A2 | |
| Hydrochloric Acid SCHEMBL27850698 | 0.78 | KCNA5 (0.42) | KCNA5ALDH1A1CYP3A4CYP2A6CYP1A2 | |
| SCHEMBL9259548 | 0.78 | KCNA5 (0.50) | KCNA5ALDH1A1CYP3A4CYP2A6CYP1A2 | |
| SCHEMBL27972619 | 0.76 | KCNA5 (0.41) | KCNA5ALDH1A1CYP3A4CYP2A6CYP1A2 | |
| SCHEMBL27972620 | 0.75 | KCNA5 (0.40) | KCNA5ALDH1A1CYP3A4CYP2A6CYP1A2 | |
| SCHEMBL1507818 | 0.75 | — | — | |
| SCHEMBL3409704 | 0.74 | CYP2A6 (0.50) | KCNA5ALDH1A1CYP3A4CYP2A6CYP1A2 |
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-114790167-A | Preparation method of 2, 3-dichloropyridine | 北京弗莱明科技有限公司 | 2022-07-26 | — | — | CN | disclosed |