Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | CDC7 | O00311 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | PRKACA | P17612 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | CDK7 | P50613 | 1/20 | 0.43 |
| ▸ | CDK9 | P50750 | 1/20 | 0.43 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.43 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1579303 | 0.84 | KDM4D (0.46) | ALDH1A1CDC7ROCK2PIM1PRKACA | |
| SCHEMBL3715043 | 0.83 | HRH4 (0.46) | ALDH1A1KDM4ECA12CA1CA2 | |
| SCHEMBL569249 | 0.79 | ALDH1A1 (0.59) | ALDH1A1KDM4EHPGDCA12CA1 | |
| SCHEMBL3854836 | 0.78 | ALDH1A1 (0.43) | ALDH1A1KDM4ECA12CA1CA2 | |
| SCHEMBL3712550 | 0.78 | HCAR3 (0.42) | HCAR3ALDH1A1CDC7ROCK2PIM1 | |
| SCHEMBL3715743 | 0.78 | ALDH1A1 (0.50) | ALDH1A1KDM4EHPGDCA12CA1 | |
| Hydrochloric Acid SCHEMBL29890892 | 0.77 | ALDH1A1 (0.57) | ALDH1A1KDM4EHPGDCA12CA1 | |
| SCHEMBL13116015 | 0.76 | CDC7 (0.47) | HCAR3ALDH1A1CDC7ROCK2PIM1 | |
| SCHEMBL4819595 | 0.76 | CDC7 (0.47) | HCAR3ALDH1A1CDC7ROCK2PIM1 | |
| SCHEMBL3711270 | 0.76 | PIK3CA (0.61) | ALDH1A1GSK3BCDK7CDK9KDM4E |
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 |