Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.40 |
| ▸ | MAPK3 | P27361 | 2/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPGDS | O60760 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.37 |
| ▸ | CDK2 | P24941 | 4/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.37 |
| ▸ | RPS6KA1 | Q15418 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2419105 | 0.84 | TDP1 (0.41) | TDP1ALDH1A1KDM4EHPGDSCCNT1 | |
| SCHEMBL21143647 | 0.82 | IDH1 (0.45) | TDP1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL2024072 | 0.81 | MAPK1 (0.41) | LRRK2OPRK1MAPK1MAPK3CCNE1 | |
| SCHEMBL31330409 | 0.79 | LRRK2 (0.51) | LRRK2OPRK1MAPK1MAPK3HDAC3 | |
| SCHEMBL23304492 | 0.77 | TDP1 (0.44) | TDP1LRRK2MAPK1KDM4E | |
| SCHEMBL2414787 | 0.77 | ALDH1A1 (0.52) | MAPK1ALDH1A1CDK2CCNT1 | |
| SCHEMBL569249 | 0.74 | ALDH1A1 (0.59) | TDP1ALDH1A1KDM4E | |
| SCHEMBL3715743 | 0.74 | ALDH1A1 (0.50) | TDP1ALDH1A1KDM4E | |
| SCHEMBL23684534 | 0.73 | HCAR3 (0.54) | TDP1LRRK2MAPK1KDM4ECDK2 | |
| SCHEMBL17113096 | 0.73 | HSD17B10 (0.44) | LRRK2OPRK1HDAC3HDAC1HDAC2 |
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 |