Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.37 |
| ▸ | NQO2 | P16083 | 3/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.37 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.37 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.37 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.37 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.37 |
| ▸ | MAP3K11 | Q16584 | 2/20 | 0.36 |
| ▸ | TERT | O14746 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1805778 | 0.88 | BRD4 (0.43) | BRD4CYP19A1NQO2GRIN2DGRIN3B | |
| SCHEMBL1806677 | 0.87 | BRD4 (0.41) | BRD4GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL8871768 | 0.79 | TNF (0.41) | BRD4GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL5261238 | 0.75 | PDE3B (0.40) | CYP19A1NQO2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL2002754 | 0.72 | KDM4E (0.46) | GRIN2DGRIN3BGRIN1GRIN2AGRIN2B | |
| SCHEMBL24392618 | 0.72 | KDM4E (0.43) | BRD4GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL5263286 | 0.71 | KMT2A (0.39) | BRD4CYP19A1NQO2GRIN2DGRIN3B | |
| SCHEMBL13160153 | 0.70 | BRD4 (0.48) | BRD4GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL8813028 | 0.70 | ABL1 (0.49) | BRD4MTNR1AMTNR1BALDH1A1 | |
| SCHEMBL10743369 | 0.70 | PDE3B (0.44) | CYP19A1NQO2GRIN2DGRIN3BGRIN1 |
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-1644369-A2 | ARYLAMINE-SUBSTITUTED QUINAZOLINONE COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-04-12 | — | — | EP | disclosed |
| WO-2005005395-A2 | ARYLAMINE-SUBSTITUTED QUINAZOLINONE COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-01-20 | — | — | WO | disclosed |