Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.47 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | RORC | P51449 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4919634 | 0.99 | HDAC1 (0.48) | HDAC1HDAC8HDAC3HDAC4HDAC7 | |
| SCHEMBL5334365 | 0.88 | HDAC1 (0.51) | HDAC1HDAC8HDAC3HDAC4HDAC7 | |
| SCHEMBL2472519 | 0.83 | HDAC1 (0.50) | HDAC1HDAC8HDAC3HDAC4HDAC7 | |
| SCHEMBL1717947 | 0.83 | SLC6A4 (0.41) | SERPINE1 | |
| SCHEMBL2473984 | 0.83 | ADRB3 (0.50) | HDAC1HDAC8HDAC3HDAC4HDAC7 | |
| Hydrochloric Acid SCHEMBL4922816 | 0.83 | HDAC1 (0.49) | HDAC1HDAC8HDAC3HDAC4HDAC7 | |
| Hydrochloric Acid SCHEMBL4919607 | 0.82 | MMP2 (0.40) | SERPINE1 | |
| SCHEMBL2470985 | 0.79 | ALDH1A1 (0.50) | FFAR4MAPTSMN1; SMN2DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL4920272 | 0.78 | ALDH1A1 (0.49) | FFAR4MAPTSMN1; SMN2DRD2DRD3 | |
| Propane SCHEMBL7208561 | 0.76 | HTR6 (0.58) | HDAC1HDAC8HDAC3HDAC4HDAC7 |
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-2371814-A1 | Aminoethylaromatic compounds suitable for treating disorders that respond to modulation of the dopamine D3 receptor | Abbott GmbH & Co. KG (DE) | 2011-10-05 | — | — | EP | disclosed |