Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.64 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.61 |
| ▸ | RECQL | P46063 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | CA12 | O43570 | 1/20 | 0.57 |
| ▸ | CA1 | P00915 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 1/20 | 0.57 |
| ▸ | CA9 | Q16790 | 1/20 | 0.57 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.56 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | DRD2 | P14416 | 2/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.51 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.50 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL13862949 | 1.00 | KDM4E (0.65) | KDM4EALDH1A1TDP1PANK3RECQL | |
| SCHEMBL5901321 | 0.87 | KDM4E (0.68) | KDM4EALDH1A1TDP1PANK3RECQL | |
| SCHEMBL8235906 | 0.85 | KDM4E (0.69) | KDM4EALDH1A1TDP1PANK3RECQL | |
| SCHEMBL14566007 | 0.84 | KDM4E (0.62) | KDM4EALDH1A1TDP1PANK3RECQL | |
| SCHEMBL3334496 | 0.83 | KDM4E (0.69) | KDM4EALDH1A1TDP1PANK3RECQL | |
| SCHEMBL3334438 | 0.83 | KDM4E (0.69) | KDM4EALDH1A1TDP1PANK3RECQL | |
| SCHEMBL8167178 | 0.83 | KDM4E (0.69) | KDM4EALDH1A1TDP1PANK3RECQL | |
| SCHEMBL3538823 | 0.82 | KDM4E (0.59) | KDM4EALDH1A1TDP1PANK3RECQL | |
| SCHEMBL3336022 | 0.82 | KDM4E (0.65) | KDM4EALDH1A1TDP1PANK3RECQL | |
| SCHEMBL2076147 | 0.81 | ALDH1A1 (0.60) | KDM4EALDH1A1TDP1PANK3RECQL |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4003999-A1 | 1-(6-(METHOXY)PYRIDAZIN-3-YL)CYCLOPROPANE-1-CARBOXAMIDE DERIVATIVES AS AUTOTAXIN (ATX) MODULATORS FOR THE TREATMENT OF INFLAMMATORY AIRWAY DISEASES | Boehringer Ingelheim International GmbH (DE) | 2022-06-01 | — | — | EP | disclosed |