Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH2 | P05091 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | PTGES | O14684 | 3/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.36 |
| ▸ | XIAP | P98170 | 3/20 | 0.36 |
| ▸ | BIRC2 | Q13490 | 3/20 | 0.36 |
| ▸ | GRM5 | P41594 | 2/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | SNCA | P37840 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3713867 | 0.89 | ALDH2 (0.38) | ALDH2FFAR1PTGESAKR1C3XIAP | |
| SCHEMBL3721286 | 0.85 | FFAR1 (0.39) | ALDH2FFAR1XIAPBIRC2GRM5 | |
| SCHEMBL3714355 | 0.80 | MMP2 (0.42) | HDAC1HDAC6 | |
| SCHEMBL13188252 | 0.77 | FFAR1 (0.41) | FFAR1PTGESXIAPBIRC2GRM5 | |
| SCHEMBL3721229 | 0.77 | SLC2A1 (0.39) | ALDH2FFAR1XIAPBIRC2GRM5 | |
| SCHEMBL3721790 | 0.73 | HDAC6 (0.41) | FFAR1PTGESAKR1C3GRM5CHRNB2 | |
| SCHEMBL3715059 | 0.72 | SLC2A1 (0.39) | ALDH2FFAR1PTGESAKR1C3XIAP | |
| SCHEMBL3716448 | 0.71 | TNIK (0.42) | FFAR1PTGESAKR1C3GRM5CHRNB2 | |
| SCHEMBL3713900 | 0.71 | GRM5 (0.40) | ALDH2FFAR1GRM5CYP2A6 | |
| SCHEMBL3721418 | 0.71 | CCNC (0.41) | — |
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 |