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 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | CLK2 | P49760 | 1/20 | 0.38 |
| ▸ | CLK3 | P49761 | 1/20 | 0.38 |
| ▸ | XIAP | P98170 | 2/20 | 0.37 |
| ▸ | BIRC2 | Q13490 | 2/20 | 0.37 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 1/20 | 0.37 |
| ▸ | CSF1R | P07333 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 2/20 | 0.35 |
| ▸ | PTGES | O14684 | 2/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL3720871 | 0.89 | CLK2 (0.37) | ADORA3ADORA2AADORA1CLK2CLK3 | |
| SCHEMBL3715718 | 0.85 | XIAP (0.45) | CYP19A1CYP11B1CYP11B2ADORA3ADORA2A | |
| SCHEMBL3712399 | 0.85 | GRM5 (0.46) | CYP19A1CYP11B1CYP11B2ADORA3ADORA2A | |
| SCHEMBL3711486 | 0.85 | CYP19A1 (0.39) | CYP19A1CYP11B1CYP11B2ADORA3ADORA2A | |
| SCHEMBL3710580 | 0.85 | NPC1 (0.42) | CYP19A1CYP11B1CYP11B2ADORA3ADORA2A | |
| SCHEMBL3713936 | 0.84 | ADORA3 (0.47) | CYP19A1CYP11B1CYP11B2ADORA3ADORA2A | |
| SCHEMBL3713666 | 0.84 | CYP19A1 (0.39) | CYP19A1CYP11B1CYP11B2ADORA3ADORA2A | |
| SCHEMBL3711552 | 0.83 | ALDH1A1 (0.46) | CYP19A1CYP11B1CYP11B2ALDH1A1CSF1R | |
| SCHEMBL3712323 | 0.83 | CYP19A1 (0.46) | CYP19A1CYP11B1CYP11B2XIAPBIRC2 | |
| SCHEMBL3713698 | 0.83 | PTGES (0.42) | CYP19A1CYP11B1CYP11B2XIAPBIRC2 |
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 |