Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 6/20 | 0.64 |
| ▸ | GSK3B | P49841 | 1/20 | 0.59 |
| ▸ | NOS3 | P29474 | 2/20 | 0.59 |
| ▸ | NOS1 | P29475 | 2/20 | 0.59 |
| ▸ | NOS2 | P35228 | 2/20 | 0.59 |
| ▸ | CDC7 | O00311 | 1/20 | 0.47 |
| ▸ | PIM1 | P11309 | 1/20 | 0.46 |
| ▸ | CDK9 | P50750 | 1/20 | 0.46 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.46 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.46 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 3/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL25877903 | 0.84 | DYRK1A (0.49) | DYRK1AGSK3BNOS3NOS1NOS2 | |
| SCHEMBL22272613 | 0.81 | DYRK1A (0.46) | DYRK1AGSK3BNOS3NOS1NOS2 | |
| SCHEMBL22272939 | 0.80 | DYRK1A (0.44) | DYRK1AGSK3BNOS3NOS1NOS2 | |
| SCHEMBL22272941 | 0.80 | MAOA (0.45) | DYRK1AGSK3BNOS3NOS1NOS2 | |
| SCHEMBL30091626 | 0.80 | DYRK1A (0.44) | DYRK1AGSK3BNOS3NOS1NOS2 | |
| SCHEMBL23927511 | 0.79 | TSHR (0.46) | DYRK1AGSK3BKDM4ECYP3A4CYP2D6 | |
| SCHEMBL25877820 | 0.79 | DYRK1A (0.43) | DYRK1AGSK3BNOS3NOS1NOS2 | |
| SCHEMBL30091686 | 0.79 | TSHR (0.46) | DYRK1AGSK3BKDM4ECYP3A4CYP2D6 | |
| SCHEMBL22272533 | 0.78 | DYRK1A (0.43) | DYRK1AGSK3BNOS3NOS1NOS2 | |
| SCHEMBL17054241 | 0.78 | CYP11B2 (0.55) | CYP11B1CYP11B2KDM4E |
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-2023138433-A2 | AMIDE COMPOUND HAVING RIPK1 INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR, AND USE THEREOF | 中国科学院上海药物研究所 | 2023-07-27 | — | — | WO | disclosed |