Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | MAPT | P10636 | 4/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.59 |
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.59 |
| ▸ | THRB | P10828 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | EGFR | P00533 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 3/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.41 |
| ▸ | TUBB | P07437 | 1/20 | 0.41 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.41 |
| ▸ | TUBA1B | P68363 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30507409 | 1.00 | ALDH1A1 (0.59) | ALDH1A1MAPTKDM4EHPGDHSD17B10 | |
| SCHEMBL6208739 | 0.87 | MAPT (0.56) | ALDH1A1MAPTKDM4EHPGDHSD17B10 | |
| SCHEMBL392780 | 0.82 | NQO2 (0.57) | ALDH1A1MAPTKDM4EHPGDHSD17B10 | |
| SCHEMBL29857369 | 0.82 | KDM4E (0.54) | ALDH1A1MAPTKDM4EHPGDHSD17B10 | |
| SCHEMBL29889991 | 0.81 | KDM4E (0.52) | ALDH1A1MAPTKDM4EHPGDHSD17B10 | |
| SCHEMBL30507425 | 0.81 | ALDH1A1 (0.46) | ALDH1A1MAPTKDM4EHPGDHSD17B10 | |
| SCHEMBL28513249 | 0.81 | ALDH1A1 (0.46) | ALDH1A1MAPTKDM4EHPGDHSD17B10 | |
| SCHEMBL6608635 | 0.78 | AR (0.47) | ALDH1A1KDM4EHPGDHSD17B10EGFR | |
| SCHEMBL18288081 | 0.78 | L3MBTL1 (0.60) | ALDH1A1MAPTKDM4EHPGDHSD17B10 | |
| SCHEMBL11825468 | 0.77 | ALDH1A1 (0.62) | ALDH1A1MAPTKDM4EHPGDHSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112010844-B | Preparation method and application of N- (pyrimidine-2-yl) coumarin-7-amine derivative as protein kinase inhibitor | 中国药科大学 | 2023-07-25 | — | — | CN | disclosed |
| CN-112010844-A | Preparation method and application of N- (pyrimidine-2-yl) coumarin-7-amine derivative as protein kinase inhibitor | 中国药科大学 | 2020-12-01 | — | — | CN | disclosed |
| US-6143766-A | ENZYME INHIBITORS WITH IMIDAZOLE GROUPS | WARNER-LAMBERT COMPANY (US) | 2000-11-07 | — | — | US | disclosed |