Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 6/20 | 0.38 |
| ▸ | FLT3 | P36888 | 2/20 | 0.38 |
| ▸ | TYRO3 | Q06418 | 2/20 | 0.38 |
| ▸ | MERTK | Q12866 | 2/20 | 0.38 |
| ▸ | GAS6 | Q14393 | 2/20 | 0.38 |
| ▸ | AXL | P30530 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.37 |
| ▸ | IGF1R | P08069 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.36 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL3713374 | 0.79 | ESR1 (0.46) | ESR1RAB9AAKR1C4AKR1C3AKR1C2 | |
| SCHEMBL3714237 | 0.77 | KDM4E (0.43) | TYRO3MERTKGAS6RAB9AMAPK1 | |
| SCHEMBL3713408 | 0.76 | L3MBTL1 (0.39) | IGF1RP2RY12MAPK1 | |
| SCHEMBL3711572 | 0.75 | MAPT (0.47) | ESR1RAB9AHSD17B10MAPK1 | |
| SCHEMBL3713336 | 0.74 | ESR1 (0.41) | ESR1RAB9AAKR1C4AKR1C3AKR1C2 | |
| SCHEMBL3714807 | 0.73 | CA12 (0.46) | RAB9AMAPK1 | |
| SCHEMBL3713822 | 0.72 | TSHR (0.54) | HDAC3IGF1RRAB9AMAPK1 | |
| SCHEMBL3711025 | 0.72 | ESR1 (0.39) | ESR1IGF1RAKR1C4AKR1C3AKR1C2 | |
| SCHEMBL3712970 | 0.70 | ALDH1A1 (0.45) | HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL31277364 | 0.68 | ESR1 (0.56) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 |
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-2010100475-A1 | HYDROXAMIC ACID DERIVATIVES AS GRAM-NEGATIVE ANTIBACTERIAL AGENTS | ASTRAZENECA AB (SE) | 2010-09-10 | — | — | WO | disclosed |