Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 4/20 | 0.43 |
| ▸ | PDE2A | O00408 | 4/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 4/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 4/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 4/20 | 0.38 |
| ▸ | ABL1 | P00519 | 2/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 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 | |
|---|---|---|---|---|
| SCHEMBL23956537 | 0.86 | DYRK1A (0.41) | DYRK1APDE2APDE10AGSK3BAAK1 | |
| SCHEMBL22272533 | 0.81 | DYRK1A (0.43) | DYRK1AGSK3BAAK1ABL1S1PR1 | |
| SCHEMBL22918783 | 0.80 | NOS3 (0.55) | DYRK1APDE2APDE10AAAK1S1PR1 | |
| SCHEMBL29615423 | 0.80 | NOS3 (0.55) | DYRK1APDE2APDE10AAAK1S1PR1 | |
| SCHEMBL25877728 | 0.79 | DYRK1A (0.64) | DYRK1AGSK3BAAK1ABL1PIM1 | |
| SCHEMBL25877903 | 0.79 | DYRK1A (0.49) | DYRK1AGSK3BAAK1ABL1S1PR1 | |
| SCHEMBL22272941 | 0.78 | MAOA (0.45) | DYRK1AGSK3BAAK1ABL1S1PR1 | |
| SCHEMBL22272939 | 0.78 | DYRK1A (0.44) | DYRK1AGSK3BAAK1ABL1S1PR1 | |
| SCHEMBL30091626 | 0.78 | DYRK1A (0.44) | DYRK1AGSK3BAAK1ABL1S1PR1 | |
| SCHEMBL23956533 | 0.78 | PDE2A (0.45) | DYRK1APDE2APDE10AGSK3BAAK1 |
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 |