Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11278078 | 0.83 | CYP2D6 (0.61) | CYP2D6CYP2C19KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL3806604 | 0.78 | KCNH2 (0.41) | KMT2ATLR8MEN1 | |
| SCHEMBL8385253 | 0.76 | KCNH2 (0.44) | ESR1ALDH1A1 | |
| SCHEMBL9380817 | 0.75 | ESR1 (0.34) | KMT2AESR1ESR2SMN1; SMN2MEN1 | |
| SCHEMBL305259 | 0.73 | CYP2D6 (0.65) | CYP2D6CYP2C19KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL9217028 | 0.73 | CYP2D6 (0.69) | CYP2D6CYP2C19KMT2AESR1ALDH1A1 | |
| SCHEMBL2578650 | 0.72 | KMT2A (0.47) | CYP2D6CYP2C19KMT2AESR1ESR2 | |
| SCHEMBL1321965 | 0.72 | KMT2A (0.39) | KMT2AESR1ESR2ALDH1A1TLR8 | |
| SCHEMBL13329883 | 0.72 | DNM2 (0.57) | ESR1ESR2ALDH1A1SMN1; SMN2TLR8 | |
| SCHEMBL13329881 | 0.72 | DNM2 (0.57) | ESR1ESR2ALDH1A1SMN1; SMN2TLR8 |
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 |