Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL21094385 | 0.89 | PKM (0.47) | ALDH1A1KCNH2SCN3APKMLMNA | |
| SCHEMBL20835402 | 0.88 | ALDH1A1 (0.45) | ALDH1A1TDP1KCNH2SCN3APOLB | |
| SCHEMBL21094391 | 0.85 | KCNH2 (0.42) | ALDH1A1TDP1KCNH2SCN3ARIPK1 | |
| SCHEMBL21094390 | 0.83 | ALDH1A1 (0.38) | ALDH1A1TDP1KCNH2SCN3ARIPK1 | |
| SCHEMBL21094396 | 0.83 | RIPK1 (0.39) | ALDH1A1TDP1KCNH2SCN3ARIPK1 | |
| SCHEMBL21094399 | 0.82 | KCNH2 (0.38) | ALDH1A1TDP1KCNH2SCN3ARIPK1 | |
| SCHEMBL21094100 | 0.81 | SSTR4 (0.39) | ALDH1A1TDP1KCNH2SCN3ARIPK1 | |
| SCHEMBL21093663 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TDP1KCNH2SCN3APKM | |
| SCHEMBL24220439 | 0.78 | KCNH2 (0.49) | ALDH1A1TDP1KCNH2SCN3APKM | |
| SCHEMBL20835748 | 0.78 | KCNH2 (0.49) | ALDH1A1TDP1KCNH2SCN3APKM |
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-2019112024-A1 | PYRROLIDINE COMPOUND | キッセイ薬品工業株式会社 | 2019-06-13 | — | — | WO | disclosed |