Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | CLK1 | P49759 | 8/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 7/20 | 0.39 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.39 |
| ▸ | METAP2 | P50579 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CDK8 | P49336 | 3/20 | 0.36 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.34 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22793581 | 0.83 | ALDH1A1 (0.51) | CLK1DYRK1AALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL22448314 | 0.78 | IP6K1 (0.56) | ABL1IP6K1METAP2ALDH1A1CYP1A2 | |
| SCHEMBL21303629 | 0.77 | CDC7 (0.51) | IP6K1MAP4K4 | |
| SCHEMBL22448313 | 0.76 | MAP4K4 (0.52) | IP6K1MAP4K4ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL21303660 | 0.76 | IP6K1 (0.51) | ABL1CLK1DYRK1AIP6K1METAP2 | |
| SCHEMBL21303661 | 0.74 | QPCT (0.51) | ABL1CLK1DYRK1AALDH1A1ALOX15 | |
| SCHEMBL21303616 | 0.74 | FFAR1 (0.51) | IP6K1ALDH1A1TDP1 | |
| SCHEMBL21303622 | 0.73 | LTA4H (0.54) | CLK1DYRK1AALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL21303610 | 0.71 | QPCT (0.47) | ABL1CLK1DYRK1AMAP4K4ALDH1A1 | |
| SCHEMBL21303627 | 0.71 | RAB9A (0.47) | ABL1IP6K1ALDH1A1CYP1A2CYP2C19 |
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-3589632-B1 | NOVEL INHIBITORS OF BACTERIAL GLUTAMINYL CYCLASES FOR USE IN THE TREATMENT OF PERIODONTAL AND RELATED DISEASES | Fraunhofer-Gesellschaft zur Förderung der Angewandten Forschung Ev (DE) | 2020-09-23 | — | — | EP | disclosed |
| WO-2019162458-A1 | NOVEL INHIBITORS OF BACTERIAL GLUTAMINYL CYCLASES FOR USE IN THE TREATMENT OF PERIODONTAL AND RELATED DISEASES | Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) | 2019-08-29 | — | — | WO | disclosed |