Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | RPA1 | P27694 | 1/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | YWHAG | P61981 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | F9 | P00740 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.35 |
| ▸ | ATXN2 | Q99700 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL3663358 | 0.80 | HTR3E (0.51) | IDO1PNMTTAAR1 | |
| Hydrochloric Acid SCHEMBL1623226 | 0.76 | IDO1 (0.37) | IDO1PIK3CADAOHDAC3HDAC1 | |
| SCHEMBL3662510 | 0.74 | MMP2 (0.39) | — | |
| SCHEMBL3663873 | 0.74 | CYP1A2 (0.48) | HDAC1 | |
| SCHEMBL15517814 | 0.74 | PIK3CA (0.47) | IDO1PIK3CADAOHDAC3HDAC1 | |
| SCHEMBL4847962 | 0.74 | PNMT (0.43) | IDO1PIK3CADAOPNMTTAAR1 | |
| Hydrochloric Acid SCHEMBL4718123 | 0.73 | PNMT (0.42) | IDO1PIK3CADAOPNMTTAAR1 | |
| SCHEMBL6917155 | 0.72 | PNMT (0.49) | IDO1PNMTTAAR1TSHR | |
| SCHEMBL11716776 | 0.71 | PNMT (0.52) | IDO1PNMTTAAR1TSHR | |
| SCHEMBL2791406 | 0.71 | PIK3CA (0.54) | IDO1PIK3CAHDAC3HDAC1HDAC2 |
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-2139895-A1 | AZA-PYRIDOPYRIMIDINONE DERIVATIVES | F. Hoffmann-Roche AG (CH) | 2010-01-06 | — | — | EP | disclosed |
| WO-2008116742-A1 | AZA-PYRIDOPYRIMIDINONE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2008-10-02 | — | — | WO | disclosed |