Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 10/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | BACE1 | P56817 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 8/20 | 0.45 |
| ▸ | NCOR2 | Q9Y618 | 6/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CFTR | P13569 | 1/20 | 0.43 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.42 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL23992177 | 0.83 | HDAC1 (0.62) | HDAC3HDAC1HDAC2NCOR2NCOR1 | |
| SCHEMBL30416650 | 0.80 | HDAC3 (0.63) | HDAC3KMT2AMEN1PTGS1HDAC1 | |
| SCHEMBL866564 | 0.80 | P2RX1 (0.49) | KMT2AMEN1PTGS1HDAC2KDM4E | |
| SCHEMBL27114491 | 0.77 | HDAC1 (0.63) | HDAC3KMT2AMEN1HDAC1HDAC2 | |
| SCHEMBL1233684 | 0.77 | KCNQ3 (0.60) | KMT2ABACE1MEN1PTGS1HDAC1 | |
| SCHEMBL16060789 | 0.76 | KDM4E (0.57) | KMT2AMEN1PTGS1HDAC1HDAC2 | |
| SCHEMBL24086686 | 0.76 | HDAC3 (0.77) | HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL2235637 | 0.75 | CYP1A2 (0.55) | HDAC3KMT2AMEN1PTGS1HDAC1 | |
| SCHEMBL14967989 | 0.75 | PTGS1 (0.51) | HDAC3KMT2APTGS1HDAC1HDAC2 | |
| SCHEMBL14453684 | 0.75 | PTGS1 (0.61) | HDAC3PTGS1HDAC1HDAC2 |
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-2021219040-A1 | HISTONE DEACETYLASE INHIBITORS FOR IMMUNOMODULATION IN TUMOR MICROENVIRONMENT | GNT BIOTECH & MEDICALS CORPORATION (CN) | 2021-11-04 | — | — | WO | disclosed |