Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.34 |
| ▸ | PARP1 | P09874 | 2/20 | 0.34 |
| ▸ | CCNE2 | O96020 | 5/20 | 0.34 |
| ▸ | CDK4 | P11802 | 5/20 | 0.34 |
| ▸ | CCND1 | P24385 | 5/20 | 0.34 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.34 |
| ▸ | CDK2 | P24941 | 5/20 | 0.34 |
| ▸ | CAMK2B | Q13554 | 5/20 | 0.34 |
| ▸ | CAMK2G | Q13555 | 5/20 | 0.34 |
| ▸ | CAMK2D | Q13557 | 5/20 | 0.34 |
| ▸ | CAMK2A | Q9UQM7 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | PRKACA | P17612 | 3/20 | 0.34 |
| ▸ | PRKACG | P22612 | 3/20 | 0.34 |
| ▸ | PRKACB | P22694 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3846941 | 0.80 | KCNH2 (0.47) | HSD17B10ALOX15KCNH2PARP1KDM4E | |
| SCHEMBL5044764 | 0.77 | PARP1 (0.32) | KCNH2PARP1SMN1; SMN2 | |
| SCHEMBL3846224 | 0.72 | PARP1 (0.46) | HSD17B10KCNH2PARP1KDM4EALDH1A1 | |
| SCHEMBL5047640 | 0.72 | MPO (0.36) | GAAKCNH2PARP1KDM4EALDH1A1 | |
| SCHEMBL5047695 | 0.68 | PARP1 (0.38) | KCNH2PARP1HTR2AHTR2C | |
| SCHEMBL5050024 | 0.68 | MPO (0.35) | GAAKCNH2PARP1KDM4EALDH1A1 | |
| SCHEMBL27495582 | 0.66 | HTR2A (0.58) | KCNH2KDM4ESMN1; SMN2HTR2AHTR2C | |
| SCHEMBL5050047 | 0.65 | KCNH2 (0.35) | GAAKCNH2PARP1KDM4EALDH1A1 | |
| SCHEMBL31378844 | 0.65 | DAO (0.40) | PARP1 | |
| SCHEMBL27512459 | 0.65 | GRM2 (0.48) | KCNH2ALDH1A1HTR2AHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| EP-1893599-A1 | COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS | AstraZeneca AB (SE) | 2008-03-05 | — | — | EP | disclosed |
| WO-2006134378-A1 | COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS | ASTRAZENECA AB (SE) | 2006-12-21 | — | — | WO | disclosed |