Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | CCR1 | P32246 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CTSG | P08311 | 1/20 | 0.44 |
| ▸ | CMA1 | P23946 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13353666 | 0.82 | CCR1 (0.51) | HDAC3HDAC1HDAC2HDAC6CCR1 | |
| SCHEMBL11888889 | 0.82 | HDAC1 (0.49) | HDAC3HDAC1HDAC2HDAC6CCR1 | |
| SCHEMBL16644532 | 0.80 | CYP2C19 (0.67) | HDAC3HDAC1HDAC2HDAC6CYP2C19 | |
| SCHEMBL5369302 | 0.79 | CYP3A4 (0.59) | CYP2C19CTSGCMA1TDP1KMT2A | |
| SCHEMBL10282914 | 0.79 | CYP2C9 (0.55) | CYP2C19KMT2ATSHRCYP3A4CYP2C9 | |
| SCHEMBL11888911 | 0.77 | HDAC3 (0.50) | HDAC3HDAC1HDAC2HDAC6CCR1 | |
| SCHEMBL19375077 | 0.76 | TSHR (0.66) | CYP2C19CTSGCMA1KMT2AEPHX2 | |
| SCHEMBL14818738 | 0.76 | TSHR (0.71) | CYP2C19KMT2AEPHX2TSHRCYP3A4 | |
| SCHEMBL8903216 | 0.76 | TSHR (0.66) | CYP2C19CTSGCMA1KMT2AEPHX2 | |
| SCHEMBL28061777 | 0.75 | CYP3A4 (0.50) | CCR1CYP2C19CTSGCMA1TDP1 |
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-3055299-B1 | PYRIMIDINE HYDROXY AMIDE COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS | ACETYLON PHARMACEUTICALS INC (US) | 2021-01-06 | — | — | EP | disclosed |