Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL20939798 | 0.77 | MAP3K14 (0.34) | MAP3K14 | |
| SCHEMBL20400203 | 0.76 | NLRP3 (0.38) | ALDH1A1MAPK1HTTCYP1A2MAPT | |
| SCHEMBL22421130 | 0.75 | MAP3K14 (0.34) | ALDH1A1HTTMAP3K14CYP1A2MAPT | |
| SCHEMBL29777572 | 0.74 | KDM4E (0.35) | ALDH1A1MAPK1HTTCYP1A2MAPT | |
| SCHEMBL22421149 | 0.72 | MAP3K14 (0.39) | MAP3K14 | |
| SCHEMBL20939184 | 0.69 | MAP3K14 (0.33) | MAP3K14 | |
| SCHEMBL29777626 | 0.69 | PKM (0.35) | ALDH1A1MAPK1HTTCYP1A2 | |
| SCHEMBL20939543 | 0.68 | MAP3K14 (0.33) | MAP3K14 | |
| SCHEMBL29777585 | 0.68 | POLB (0.38) | ALDH1A1MAPK1HTT | |
| SCHEMBL29777621 | 0.68 | CYP2C19 (0.37) | ALDH1A1MAPK1HTTMAPTCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3478673-B1 | CYANOINDOLINE DERIVATIVES AS NIK INHIBITORS | JANSSEN PHARMACEUTICA NV (BE) | 2020-09-16 | — | — | EP | disclosed |