Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3712909 | 0.83 | HCAR3 (0.46) | GAAALDH1A1KDM4ECA12CA1 | |
| SCHEMBL17113016 | 0.83 | GAA (0.42) | HRH4ALOX5PPARGGAAALDH1A1 | |
| SCHEMBL1579303 | 0.82 | KDM4D (0.46) | HRH4GAAALDH1A1KDM4ECA12 | |
| SCHEMBL3716263 | 0.80 | ESR1 (0.45) | HRH4ALOX5PPARGGAAESR1 | |
| SCHEMBL13277358 | 0.78 | ALDH1A1 (0.46) | GAAALDH1A1KDM4EHSD17B10CA12 | |
| SCHEMBL569249 | 0.77 | ALDH1A1 (0.59) | GAAALDH1A1KDM4ENPSR1CA12 | |
| SCHEMBL3853514 | 0.76 | HCAR3 (0.43) | GAAALDH1A1KDM4EHSD17B10CA12 | |
| SCHEMBL3853513 | 0.76 | HCAR3 (0.43) | GAAALDH1A1KDM4EHSD17B10CA12 | |
| SCHEMBL3854836 | 0.76 | ALDH1A1 (0.43) | GAAALDH1A1KDM4ECA12CA1 | |
| SCHEMBL3715743 | 0.76 | ALDH1A1 (0.50) | GAAALDH1A1KDM4ENPSR1CA12 |
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-2010100475-A1 | HYDROXAMIC ACID DERIVATIVES AS GRAM-NEGATIVE ANTIBACTERIAL AGENTS | ASTRAZENECA AB (SE) | 2010-09-10 | — | — | WO | disclosed |
| WO-2010100475-A1 | HYDROXAMIC ACID DERIVATIVES AS GRAM-NEGATIVE ANTIBACTERIAL AGENTS | ASTRAZENECA AB (SE) | 2010-09-10 | — | — | WO | disclosed |