Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | TK1 | P04183 | 1/20 | 0.39 |
| ▸ | SLC34A1 | Q06495 | 1/20 | 0.38 |
| ▸ | UPP1 | Q16831 | 1/20 | 0.38 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.38 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 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 | |
|---|---|---|---|---|
| SCHEMBL1687635 | 0.95 | ALDH1A1 (0.46) | ALDH1A1CYP2C9CYP2C19RXFP1SIRT2 | |
| SCHEMBL1287915 | 0.82 | ALDH1A1 (0.39) | ALDH1A1CYP2C9CYP2C19SLC34A1L3MBTL1 | |
| SCHEMBL9597854 | 0.76 | ALDH1A1 (0.53) | ALDH1A1CYP2C9CYP2C19TK1UPP1 | |
| SCHEMBL9016369 | 0.76 | ALDH1A1 (0.56) | ALDH1A1CYP2C9CYP2C19TK1UPP1 | |
| SCHEMBL1687638 | 0.75 | ADORA2A (0.36) | ALDH1A1SLC34A1L3MBTL1HPGD | |
| SCHEMBL1288013 | 0.73 | UPP1 (0.59) | ALDH1A1TK1UPP1HPGD | |
| SCHEMBL8067219 | 0.73 | ALDH1A1 (0.55) | ALDH1A1CYP2C9CYP2C19TK1UPP1 | |
| SCHEMBL1287950 | 0.72 | KMT2A (0.36) | ALDH1A1CYP2C9CYP2C19L3MBTL1SMN1; SMN2 | |
| SCHEMBL10069632 | 0.72 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL7758840 | 0.72 | ALDH1A1 (0.51) | ALDH1A1CYP2C9CYP2C19TK1UPP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012047993-A2 | N-HYDROXYPYRIMIDINE-2,4-DIONES AS INHIBITORS OF HIV AND HCV | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2012-04-12 | — | — | WO | disclosed |
| WO-2012047993-A2 | N-HYDROXYPYRIMIDINE-2,4-DIONES AS INHIBITORS OF HIV AND HCV | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2012-04-12 | — | — | WO | disclosed |