Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.38 |
| ▸ | PLK4 | O00444 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.38 |
| ▸ | FLT4 | P35916 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.38 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28584809 | 0.82 | ALDH1A1 (0.49) | ALDH1A1ANO1RIPK1PLAULMNA | |
| SCHEMBL22116876 | 0.76 | KDM4E (0.47) | ALDH1A1PLAULMNAL3MBTL1SMN1; SMN2 | |
| SCHEMBL754237 | 0.75 | PLAU (0.46) | ALDH1A1PLAULMNAL3MBTL1DYRK1A | |
| SCHEMBL28585340 | 0.74 | RAB9A (0.55) | ALDH1A1LMNACNR2 | |
| SCHEMBL16861517 | 0.74 | PLAU (0.45) | ALDH1A1PLAULMNAL3MBTL1DYRK1A | |
| SCHEMBL14514051 | 0.74 | PLAU (0.53) | ALDH1A1PLAUL3MBTL1AURKARPS6KB1 | |
| SCHEMBL22832228 | 0.73 | SMN1; SMN2 (0.47) | ALDH1A1ANO1RIPK1LMNAL3MBTL1 | |
| SCHEMBL22832223 | 0.73 | MAOA (0.43) | ALDH1A1ANO1RIPK1LMNASMN1; SMN2 | |
| SCHEMBL16819693 | 0.73 | KDM4E (0.54) | ALDH1A1LMNAL3MBTL1SMN1; SMN2KDM4E | |
| SCHEMBL28592739 | 0.72 | ALDH1A1 (0.51) | ALDH1A1RIPK1LMNAL3MBTL1DYRK1A |
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-113072496-A | Preparation method of isoquinoline-1-formamide compound | 湖北工业大学 | 2021-07-06 | — | — | CN | disclosed |