Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.48 |
| ▸ | CTSV | O60911 | 2/20 | 0.47 |
| ▸ | CTSL | P07711 | 2/20 | 0.47 |
| ▸ | EGFR | P00533 | 2/20 | 0.47 |
| ▸ | KDM1A | O60341 | 1/20 | 0.47 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.46 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.46 |
| ▸ | PDE4A | P27815 | 1/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.46 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | PLK1 | P53350 | 1/20 | 0.45 |
| ▸ | KIT | P10721 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.45 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.45 |
| ▸ | MET | P08581 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL19645656 | 0.85 | ELANE (0.53) | ELANEHDAC6CTSVCTSLEGFR | |
| SCHEMBL6879935 | 0.80 | HDAC6 (0.78) | ELANEHDAC6EGFRPLK1ALDH1A1 | |
| SCHEMBL4781644 | 0.80 | IRAK1 (0.52) | ELANEHDAC6CTSVCTSLEGFR | |
| SCHEMBL4728780 | 0.77 | PDE10A (0.46) | HDAC6ALDH1A1POLBHTT | |
| SCHEMBL663991 | 0.77 | HDAC6 (0.54) | ELANEHDAC6EGFRPLK1ALDH1A1 | |
| SCHEMBL4594235 | 0.76 | HDAC6 (0.68) | HDAC6 | |
| SCHEMBL7121138 | 0.76 | KIT (0.48) | ELANECTSVCTSLEGFRKDM1A | |
| SCHEMBL4779638 | 0.75 | HDAC6 (0.47) | HDAC6EGFRATMHTT | |
| SCHEMBL4300106 | 0.75 | HDAC6 (0.60) | HDAC6EGFRALDH1A1POLBLMNA | |
| SCHEMBL10296328 | 0.75 | KDM1A (0.56) | ELANEEGFRKDM1AIRAK1IRAK4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008020302-A2 | HETEROAROMATIC QUINOLINE-BASED COMPOUNDS AS PHOSPHODIESTERASE (PDE) INHIBITORS | PFIZER PRODUCTS INC. (US) | 2008-02-21 | — | — | WO | disclosed |