Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL25262279 | 0.97 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2KDM4EGAAL3MBTL1 | |
| SCHEMBL29483787 | 0.97 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2KDM4EGAAL3MBTL1 | |
| SCHEMBL30983925 | 0.82 | SMO (0.52) | ALDH1A1GAAL3MBTL1CYP1A2HSD17B10 | |
| SCHEMBL23768880 | 0.80 | ALDH1A1 (0.36) | ALDH1A1SMN1; SMN2MAPTCYP1A2CYP2C9 | |
| SCHEMBL19121825 | 0.77 | CNR2 (0.50) | ALDH1A1SMN1; SMN2KDM4EGAAL3MBTL1 | |
| SCHEMBL30983945 | 0.76 | CKS1B (0.49) | SMN1; SMN2MAPT | |
| SCHEMBL22322207 | 0.76 | CKS1B (0.49) | SMN1; SMN2MAPT | |
| SCHEMBL1100741 | 0.74 | UHRF1 (0.48) | ALDH1A1SMN1; SMN2KDM4EGAAL3MBTL1 | |
| SCHEMBL25299638 | 0.73 | AR (0.49) | ALDH1A1SMN1; SMN2CNR2IP6K1 | |
| SCHEMBL29483799 | 0.73 | AR (0.49) | ALDH1A1SMN1; SMN2CNR2IP6K1 |
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-2021013864-A1 | 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL) -PYRIMIDINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2021-01-28 | — | — | WO | disclosed |