Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | CSF1R | P07333 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.36 |
| ▸ | XIAP | P98170 | 2/20 | 0.35 |
| ▸ | BIRC2 | Q13490 | 2/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.35 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 2/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | BCR | P11274 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | ABCC1 | P33527 | 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 | |
|---|---|---|---|---|
| SCHEMBL3790839 | 0.90 | HIF1A (0.36) | CSF1RALDH1A1HIF1AEPAS1XIAP | |
| SCHEMBL13188411 | 0.88 | CYP19A1 (0.49) | CYP19A1CYP11B1CYP11B2ALDH1A1SLC2A1 | |
| SCHEMBL3711302 | 0.88 | RAB9A (0.49) | CYP19A1CYP11B1CYP11B2CSF1RRAB9A | |
| SCHEMBL3711552 | 0.87 | ALDH1A1 (0.46) | CYP19A1CYP11B1CYP11B2CSF1RALDH1A1 | |
| SCHEMBL3713498 | 0.87 | CYP19A1 (0.39) | CYP19A1CYP11B1CYP11B2CSF1RALDH1A1 | |
| SCHEMBL3712399 | 0.85 | GRM5 (0.46) | CYP19A1CYP11B1CYP11B2ALDH1A1GRM5 | |
| SCHEMBL3712830 | 0.85 | DEGS1 (0.44) | CYP19A1CYP11B1CYP11B2CSF1RALDH1A1 | |
| SCHEMBL3713260 | 0.84 | CYP11B1 (0.48) | CYP19A1CYP11B1CYP11B2CSF1RHIF1A | |
| SCHEMBL3710087 | 0.83 | ALDH1A1 (0.43) | CYP19A1CYP11B1CYP11B2CSF1RALDH1A1 | |
| SCHEMBL3712176 | 0.83 | GRM5 (0.42) | CYP19A1CYP11B1CYP11B2CSF1RALDH1A1 |
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 |