Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 3/20 | 0.35 |
| ▸ | PIM1 | P11309 | 5/20 | 0.34 |
| ▸ | PIM2 | Q9P1W9 | 4/20 | 0.34 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | CDK7 | P50613 | 2/20 | 0.34 |
| ▸ | CDK9 | P50750 | 2/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | PAK4 | O96013 | 1/20 | 0.34 |
| ▸ | PRKACA | P17612 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21295271 | 0.75 | CYP1A2 (0.50) | ALDH1A1KDM4ECDK2MAPK14MAP4K4 | |
| SCHEMBL1998243 | 0.70 | ALDH1A1 (0.37) | ALDH1A1KDM4ECDK2MAPK14CDK7 | |
| SCHEMBL1998246 | 0.70 | ALDH1A1 (0.37) | ALDH1A1KDM4ECDK2MAPK14CDK7 | |
| SCHEMBL19881862 | 0.70 | NPSR1 (0.37) | ALDH1A1KDM4EPIM1PIM2TLR9 | |
| SCHEMBL13256589 | 0.69 | CDK2 (0.60) | ALDH1A1KDM4ECDK2PIM1PIM2 | |
| SCHEMBL17776969 | 0.68 | HTR1F (0.47) | — | |
| SCHEMBL19881892 | 0.68 | CHEK1 (0.47) | ALDH1A1KDM4EPIM1PIM2PIM3 | |
| SCHEMBL17776531 | 0.68 | GDA (0.46) | KDM4EROCK2ROCK1 | |
| SCHEMBL19881886 | 0.68 | PIM1 (0.49) | PIM1PIM2TLR9TLR8TLR7 | |
| SCHEMBL3180578 | 0.67 | ALDH1A1 (0.53) | ALDH1A1KDM4ECDK2MAPK14CDK7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3284743-B1 | HETEROCYCLIC-IMIDAZOLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, PREPARATION METHOD THEREFOR AND USE THEREOF | SHANGHAI HUILUN LIFE SCIENCE & TECH CO LTD (CN) | 2022-07-06 | — | — | EP | disclosed |
| EP-3284743-A1 | HETEROCYCLIC-IMIDAZOLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, PREPARATION METHOD THEREFOR AND USE THEREOF | Shanghai Huilun Life Science & Technology Co., Ltd (CN) | 2018-02-21 | — | — | EP | disclosed |