Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 3/20 | 0.48 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.48 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.43 |
| ▸ | USP2 | O75604 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | PTGES | O14684 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13188295 | 0.88 | ABCB1 (0.48) | ABCB1ABCG2ABCC1PTGS2CYP1A2 | |
| SCHEMBL3718011 | 0.86 | FGFR4 (0.40) | CYP1A2CYP3A4CLK4CYP2C19FFAR1 | |
| SCHEMBL3710406 | 0.85 | PIK3CA (0.46) | ABCB1ABCG2ABCC1CYP1A2CYP3A4 | |
| SCHEMBL3713514 | 0.84 | FPR2 (0.40) | PTGESFFAR1ALDH1A1ACACB | |
| SCHEMBL3714572 | 0.80 | P2RY12 (0.46) | CYP1A2CYP3A4CYP2D6CLK4CYP2C19 | |
| SCHEMBL3711805 | 0.78 | CYP19A1 (0.49) | ABCG2FFAR1ALDH1A1 | |
| SCHEMBL13188297 | 0.78 | P2RY12 (0.40) | CYP1A2CYP3A4CLK4FFAR1ALDH1A1 | |
| SCHEMBL3713214 | 0.78 | CLK4 (0.48) | CYP1A2CYP3A4CYP2D6CLK4CYP2C19 | |
| SCHEMBL3710041 | 0.77 | HDAC1 (0.46) | ABCB1ABCG2ABCC1CYP1A2CYP3A4 | |
| SCHEMBL2907007 | 0.76 | ABCB1 (0.58) | ABCB1ABCG2ABCC1CYP1A2CYP3A4 |
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 |