Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 5/20 | 0.68 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.65 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.65 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 2/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 4/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.57 |
| ▸ | GFER | P55789 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | MMP14 | P50281 | 1/20 | 0.55 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL16886015 | 0.90 | NPC1 (0.61) | HDAC1KCNMA1HDAC2HDAC3MAPK1 | |
| SCHEMBL3121589 | 0.87 | HDAC2 (0.74) | HDAC1KCNMA1HDAC2HDAC3MAPK1 | |
| SCHEMBL16317646 | 0.85 | KCNMA1 (0.76) | KCNMA1MAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL11591501 | 0.83 | HDAC1 (0.71) | HDAC1HDAC2HDAC3MAPK1MAPT | |
| SCHEMBL8820818 | 0.83 | MAPT (0.71) | KCNMA1MAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL18086524 | 0.83 | HDAC1 (0.68) | HDAC1HDAC2HDAC3CYP2C19GFER | |
| SCHEMBL15009906 | 0.83 | SMN1; SMN2 (0.50) | HDAC1MAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL865787 | 0.83 | RAB9A (0.58) | HDAC1KCNMA1MAPTMEN1KMT2A | |
| SCHEMBL30932789 | 0.83 | RAB9A (0.58) | HDAC1KCNMA1MAPTMEN1KMT2A | |
| SCHEMBL11589187 | 0.83 | KCNMA1 (0.59) | HDAC1KCNMA1HDAC2HDAC3MAPK1 |
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-2877444-B1 | INHIBITORS OF HISTONE DEACETYLASE | BROAD INST INC (US) | 2020-09-02 | — | — | EP | disclosed |