Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.61 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.52 |
| ▸ | F2 | P00734 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.48 |
| ▸ | AURKA | O14965 | 1/20 | 0.47 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.47 |
| ▸ | JAK2 | O60674 | 1/20 | 0.47 |
| ▸ | PAK4 | O96013 | 1/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.47 |
| ▸ | LCK | P06239 | 1/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.47 |
| ▸ | CSF1R | P07333 | 1/20 | 0.47 |
| ▸ | RET | P07949 | 1/20 | 0.47 |
| ▸ | IGF1R | P08069 | 1/20 | 0.47 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.47 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL443320 | 0.87 | HCAR2 (0.55) | PIK3CAPIK3CBALDH1A1PTGS2AURKA | |
| SCHEMBL3717932 | 0.87 | ALDH1A1 (0.57) | PIK3CAPIK3CBALDH1A1CA1CA2 | |
| SCHEMBL441290 | 0.84 | PIK3CA (0.59) | PIK3CAPIK3CBALDH1A1CA1CA2 | |
| SCHEMBL3716917 | 0.80 | PIK3CA (0.52) | PIK3CAPIK3CBALDH1A1CA1CA2 | |
| SCHEMBL3715503 | 0.79 | PPARA (0.51) | ALDH1A1HPGDKDM4E | |
| SCHEMBL730969 | 0.77 | LMNA (0.59) | ALDH1A1HPGDKDM4ELMNA | |
| SCHEMBL30931811 | 0.77 | LMNA (0.59) | ALDH1A1HPGDKDM4ELMNA | |
| SCHEMBL29893730 | 0.77 | CA1 (0.51) | ALDH1A1CA1CA2F2KDM4E | |
| SCHEMBL14842053 | 0.77 | NOS2 (0.58) | ALDH1A1PTGS2AURKADAPK3JAK2 | |
| SCHEMBL2135021 | 0.76 | CA1 (0.47) | ALDH1A1CA1CA2F2HPGD |
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 |