Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CDC7 | O00311 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | PRKACA | P17612 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.40 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11273015 | 0.83 | CYP2D6 (0.54) | CYP2D6CYP2C19ALDH1A1CDC7ROCK2 | |
| SCHEMBL305259 | 0.79 | CYP2D6 (0.65) | CYP2D6CYP2C19ALDH1A1CDC7ROCK2 | |
| SCHEMBL9217028 | 0.79 | CYP2D6 (0.69) | CYP2D6CYP2C19ALDH1A1CDC7ROCK2 | |
| SCHEMBL9376957 | 0.77 | NOS3 (0.36) | CYP2D6CYP2C19KMT2AGAACYP1A2 | |
| SCHEMBL23299899 | 0.76 | CYP2D6 (0.60) | CYP2D6CYP2C19ALDH1A1CDC7ROCK2 | |
| SCHEMBL8053292 | 0.76 | CYP2D6 (1.00) | CYP2D6CYP2C19ALDH1A1CDC7ROCK2 | |
| SCHEMBL3877330 | 0.75 | CYP2D6 (0.59) | CYP2D6CYP2C19ALDH1A1CDC7ROCK2 | |
| SCHEMBL10648331 | 0.75 | GAA (0.37) | CYP2D6CYP2C19ALDH1A1KMT2AGAA | |
| Hydrochloric Acid SCHEMBL8049480 | 0.75 | CYP2D6 (0.97) | CYP2D6CYP2C19ALDH1A1CDC7ROCK2 | |
| SCHEMBL1319508 | 0.73 | KMT2A (0.38) | CYP2C19KMT2AGAAMAPK1SMN1; 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 |
|---|---|---|---|---|---|---|---|
| EP-0004173-B1 | 2,3-DIHYDROIMIDAZO (1,2-C) PYRIMIDINES, THEIR PREPARATION, FORMULATIONS CONTAINING THEM AND THEIR USE AS PHARMACEUTICALS | ELI LILLY AND COMPANY (US) | 1982-09-22 | — | — | EP | disclosed |
| EP-0004173-A1 | 2,3-Dihydroimidazo (1,2-c) pyrimidines, their preparation, formulations containing them and their use as pharmaceuticals | ELI LILLY AND COMPANY (US) | 1979-09-19 | — | — | EP | disclosed |