Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 7/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | RXRA | P19793 | 1/20 | 0.34 |
| ▸ | RXRB | P28702 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9117964 | 0.79 | HTR3E (0.41) | HDAC8HDAC4HDAC2ACHECYP2D6 | |
| SCHEMBL8397799 | 0.79 | LMNA (0.40) | KIF11ALDH1A1HPGDHSD17B10MEN1 | |
| SCHEMBL4099517 | 0.74 | L3MBTL1 (0.45) | ALDH1A1HPGDTDP1MEN1HTT | |
| SCHEMBL4982058 | 0.74 | HDAC8 (0.46) | HDAC8HDAC4HDAC2ACHECYP2D6 | |
| SCHEMBL11955385 | 0.72 | HDAC8 (0.47) | HDAC8HDAC4HDAC2ACHECYP2D6 | |
| SCHEMBL4984497 | 0.72 | HDAC8 (0.46) | HDAC8HDAC6HDAC3ALDH1A1MEN1 | |
| SCHEMBL19618139 | 0.70 | HDAC8 (0.44) | HDAC8HDAC4HDAC2ACHECYP2D6 | |
| SCHEMBL7812347 | 0.70 | ALDH1A1 (0.50) | HDAC8HDAC4HDAC2ACHECYP2D6 | |
| SCHEMBL19726610 | 0.69 | HDAC8 (0.41) | HDAC8HDAC4HDAC2ACHECYP2D6 | |
| SCHEMBL8399182 | 0.69 | HDAC4 (0.44) | HDAC8HDAC4HDAC2CYP2D6CYP3A4 |
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-1995020950-A1 | THERAPEUTIC GUANIDINES | CAMBRIDGE NEUROSCIENCE, INC. (US) | 1995-08-10 | — | — | WO | disclosed |