Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.60 |
| ▸ | MAPT | P10636 | 7/20 | 0.60 |
| ▸ | HPGD | P15428 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 6/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | FDPS | P14324 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.47 |
| ▸ | ABAT | P80404 | 1/20 | 0.47 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL662081 | 0.87 | ALDH1A1 (0.57) | ALDH1A1MAPTHPGDLMNASMN1; SMN2 | |
| SCHEMBL28918506 | 0.86 | ALDH1A1 (0.67) | ALDH1A1MAPTHPGDLMNASMN1; SMN2 | |
| SCHEMBL13220915 | 0.86 | MAPT (0.62) | ALDH1A1MAPTHPGDLMNASMN1; SMN2 | |
| SCHEMBL14874596 | 0.84 | MAPT (0.62) | ALDH1A1MAPTHPGDLMNASMN1; SMN2 | |
| SCHEMBL9152389 | 0.83 | MAPT (0.60) | ALDH1A1MAPTHPGDLMNASMN1; SMN2 | |
| SCHEMBL9638940 | 0.82 | ALDH1A1 (0.56) | ALDH1A1MAPTHPGDLMNACYP1A2 | |
| SCHEMBL19331977 | 0.82 | MAPT (0.57) | ALDH1A1MAPTHPGDLMNASMN1; SMN2 | |
| SCHEMBL2925357 | 0.82 | ALDH1A1 (0.53) | ALDH1A1MAPTHPGDLMNASMN1; SMN2 | |
| SCHEMBL5692527 | 0.80 | MAPT (0.58) | ALDH1A1MAPTHPGDLMNASMN1; SMN2 | |
| SCHEMBL9153926 | 0.79 | ALDH1A1 (0.58) | ALDH1A1MAPTHPGDLMNASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106187904-B | Propiolamido-containing 2-phenylimidazole derivative and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2021-07-06 | — | — | CN | disclosed |
| CN-106187904-A | 2-phenylimidazole analog derivative containing propioloyl amido and preparation method thereof and pharmaceutical composition and purposes | 中国医学科学院药物研究所 | 2016-12-07 | — | — | CN | disclosed |