Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | PRKDC | P78527 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2309754 | 1.00 | KDM4E (0.36) | KDM4EHTTALDH1A1NPSR1PIK3R1 | |
| SCHEMBL3066491 | 0.84 | KDM4E (0.36) | KDM4EHTTALDH1A1NPSR1PIK3R1 | |
| SCHEMBL3065215 | 0.80 | ALDH1A1 (0.35) | KDM4EHTTALDH1A1NPSR1HPGD | |
| SCHEMBL3069796 | 0.79 | KDM4E (0.38) | KDM4EHTTALDH1A1NPSR1GAA | |
| SCHEMBL2309750 | 0.79 | TSHR (0.38) | KDM4EHTTALDH1A1NPSR1GAA | |
| SCHEMBL5014295 | 0.78 | TSHR (0.37) | KDM4EHTTALDH1A1NPSR1GAA | |
| SCHEMBL5014297 | 0.76 | KDM4E (0.36) | KDM4EHTTALDH1A1NPSR1PIK3R1 | |
| SCHEMBL2307645 | 0.76 | TSHR (0.36) | KDM4EHTTALDH1A1NPSR1GAA | |
| SCHEMBL2307647 | 0.75 | ALDH1A1 (0.31) | KDM4EALDH1A1GAAKMT2A | |
| SCHEMBL3653239 | 0.74 | KDM4E (0.33) | KDM4EHTTALDH1A1NPSR1PIK3R1 |
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-2193132-A2 | 3-SPIROPYRIMIDINETRIONE-QUINOLINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS | AstraZeneca AB (SE) | 2010-06-09 | — | — | EP | disclosed |
| WO-2009004382-A2 | 3-SPIROPYRIMIDINETRIONE-QUINOLINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS | ASTRAZENECA AB (SE) | 2009-01-08 | — | — | WO | disclosed |