Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | GHSR | Q92847 | 1/20 | 0.47 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.43 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.42 |
| ▸ | BRD1 | O95696 | 1/20 | 0.42 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.42 |
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 SCHEMBL4920272 | 0.99 | ALDH1A1 (0.49) | ALDH1A1MAPTLMNASMN1; SMN2PKM | |
| SCHEMBL2466084 | 0.84 | FFAR1 (0.51) | ALDH1A1MAPTLMNASMN1; SMN2PKM | |
| Hydrochloric Acid SCHEMBL4914708 | 0.83 | FFAR1 (0.50) | ALDH1A1MAPTLMNASMN1; SMN2PKM | |
| SCHEMBL2470496 | 0.82 | ADRB2 (0.57) | ALDH1A1MAPTLMNASMN1; SMN2PKM | |
| SCHEMBL1719317 | 0.82 | DRD3 (0.42) | DRD2DRD3KCNH2 | |
| Hydrochloric Acid SCHEMBL4915819 | 0.81 | ADRB2 (0.56) | ALDH1A1MAPTLMNASMN1; SMN2PKM | |
| Hydrochloric Acid SCHEMBL4918974 | 0.81 | DRD3 (0.42) | DRD2DRD3KCNH2 | |
| SCHEMBL2472476 | 0.81 | ADRB3 (0.51) | ALDH1A1MAPTLMNASMN1; SMN2PKM | |
| SCHEMBL2473909 | 0.79 | HDAC1 (0.49) | MAPTSMN1; SMN2DRD2DRD3KCNH2 | |
| Hydrochloric Acid SCHEMBL4919634 | 0.78 | HDAC1 (0.48) | MAPTSMN1; SMN2DRD2DRD3KCNH2 |
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 3 patents. 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 |
| EP-1809597-A1 | AMINOETHYLAROMATIC COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE DOPAMINE D3 RECEPTOR | Abbott GmbH & Co. KG (DE) | 2007-07-25 | — | — | EP | disclosed |
| WO-2006040179-A1 | AMINOETHYLAROMATIC COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE DOPAMINE D3 RECEPTOR | ABBOTT GMBH & CO. KG (DE) | 2006-04-20 | — | — | WO | disclosed |