Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNIK | Q9UKE5 | 2/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | PIK3C3 | Q8NEB9 | 3/20 | 0.39 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.39 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.39 |
| ▸ | GAK | O14976 | 1/20 | 0.39 |
| ▸ | STK16 | O75716 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | AXL | P30530 | 1/20 | 0.39 |
| ▸ | NEK2 | P51955 | 1/20 | 0.39 |
| ▸ | STK3 | Q13188 | 1/20 | 0.39 |
| ▸ | STK11 | Q15831 | 1/20 | 0.39 |
| ▸ | BMP2K | Q9NSY1 | 1/20 | 0.39 |
| ▸ | PTGES | O14684 | 3/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.38 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL3709369 | 0.87 | AAK1 (0.41) | TNIKMAP4K4MINK1FFAR1PIK3C3 | |
| SCHEMBL13188601 | 0.87 | SMPD1 (0.49) | PIK3C3SMPD1HCRTR1HCRTR2HDAC1 | |
| SCHEMBL13188626 | 0.84 | AAK1 (0.44) | FFAR1PIK3C3ADAM17AAK1GAK | |
| SCHEMBL3718656 | 0.84 | CHRNA7 (0.41) | TNIKFFAR1PIK3C3AAK1GAK | |
| SCHEMBL3710648 | 0.81 | SMPD1 (0.40) | FFAR1ADAM17AAK1GAKSMPD1 | |
| SCHEMBL3716930 | 0.78 | CCNE2 (0.43) | GRM5 | |
| SCHEMBL3713525 | 0.78 | MEN1 (0.43) | FFAR1ADAM17AAK1SMPD1 | |
| SCHEMBL3711625 | 0.77 | FFAR1 (0.36) | TNIKFFAR1AAK1GAKSTK16 | |
| SCHEMBL3716655 | 0.76 | FFAR1 (0.45) | FFAR1SMPD1GRM5HDAC1HDAC6 | |
| SCHEMBL3713649 | 0.76 | HDAC1 (0.52) | TNIKFFAR1AAK1GAKSTK16 |
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 |