Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13746880 | 0.87 | GAA (0.41) | HSD17B10HPGDCYP1A2CYP2C19CYP2C9 | |
| SCHEMBL11697365 | 0.72 | HPGD (0.60) | HSD17B10HPGDCYP1A2CYP2C19CYP2C9 | |
| SCHEMBL9306307 | 0.71 | HPGD (0.58) | HSD17B10HPGDCYP1A2CYP2C19CYP2C9 | |
| SCHEMBL9306298 | 0.71 | HPGD (0.58) | HSD17B10HPGDCYP1A2CYP2C19CYP2C9 | |
| SCHEMBL11191161 | 0.70 | HPGD (0.60) | HSD17B10HPGDCYP1A2CYP2C19CYP2C9 | |
| SCHEMBL1371913 | 0.69 | HPGD (0.56) | HSD17B10HPGDCYP1A2CYP2C19CYP2C9 | |
| SCHEMBL4021493 | 0.69 | KDM4E (0.38) | HPGDCYP2C19CYP2C9SMN1; SMN2MAPT | |
| SCHEMBL5536307 | 0.68 | HPGD (0.66) | HSD17B10HPGDCYP1A2CYP2C19CYP2C9 | |
| SCHEMBL9306300 | 0.68 | HPGD (0.62) | HSD17B10HPGDCYP1A2CYP2C19CYP2C9 | |
| SCHEMBL5159135 | 0.67 | HPGD (0.60) | HSD17B10HPGDCYP1A2CYP2C19CYP2C9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009100403-A1 | SUBSTITUTED ARYL PYRIMIDINONES | NEUROGEN CORPORATION (US) | 2009-08-13 | — | — | WO | disclosed |