Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.66 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.66 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.66 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.66 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.66 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.66 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.66 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.66 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.66 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.66 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.66 |
| ▸ | NPC1 | O15118 | 7/20 | 0.63 |
| ▸ | POLB | P06746 | 3/20 | 0.63 |
| ▸ | MAPT | P10636 | 2/20 | 0.63 |
| ▸ | MEN1 | O00255 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL1613715 | 0.96 | HDAC1 (0.68) | HDAC6HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL4855482 | 0.92 | NPC1 (0.67) | HDAC6HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL29728208 | 0.87 | HDAC6 (0.66) | HDAC6HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL29728194 | 0.87 | HDAC1 (0.69) | HDAC6HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL21296585 | 0.86 | NPC1 (0.70) | HDAC6HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL30444774 | 0.86 | HDAC1 (0.71) | HDAC6HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL30858825 | 0.86 | HDAC6 (0.68) | HDAC6HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL5322812 | 0.85 | HDAC6 (0.72) | HDAC6HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL29944526 | 0.84 | NPC1 (0.77) | HDAC6HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL5142389 | 0.84 | NPC1 (0.77) | HDAC6HDAC1HDAC3HDAC4HDAC7 |
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-2010040808-A1 | NOVEL QUINOLINYLAMIDE DERIVATIVES USEFUL AS MODULATORS OF DOPAMINE AND SEROTONIN RECEPTORS | NEUROSEARCH A/S (DK) | 2010-04-15 | — | — | WO | disclosed |