Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.31 |
| ▸ | MLYCD | O95822 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20746747 | 0.85 | ELANE (0.31) | ELANEHDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL21300012 | 0.78 | — | — | |
| SCHEMBL21300010 | 0.77 | MIF (0.39) | — | |
| SCHEMBL20746768 | 0.76 | ELANE (0.30) | ELANE | |
| SCHEMBL14829667 | 0.76 | ALDH1A1 (0.40) | HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL14838574 | 0.76 | ALDH1A1 (0.40) | HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL15120076 | 0.74 | HDAC3 (0.34) | ELANEHDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL21299981 | 0.72 | CYP2D6 (0.31) | — | |
| SCHEMBL21698575 | 0.72 | HDAC3 (0.37) | HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL24038574 | 0.71 | HDAC1 (0.48) | MLYCDHDAC3HDAC1HDAC2NCOR2 |
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-2940017-B1 | Process for making compounds useful as inhibitors of ATR kinase | VERTEX PHARMA (US) | 2019-08-28 | — | — | EP | disclosed |