Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 10/20 | 0.49 |
| ▸ | CNR1 | P21554 | 7/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
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 SCHEMBL4922430 | 0.99 | POLB (0.48) | CNR2CNR1POLBNPSR1TSHR | |
| SCHEMBL2470132 | 0.86 | ALDH1A1 (0.44) | CNR2CNR1ALDH1A1MAPTKMT2A | |
| Hydrochloric Acid SCHEMBL4922303 | 0.85 | ALDH1A1 (0.43) | CNR2CNR1ALDH1A1MAPTKMT2A | |
| SCHEMBL2466067 | 0.82 | SERPINE1 (0.51) | CNR2CNR1ESR1 | |
| Hydrochloric Acid SCHEMBL4920488 | 0.81 | SERPINE1 (0.50) | CNR2POLBESR1 | |
| SCHEMBL1718081 | 0.78 | DRD3 (0.42) | POLBALDH1A1MAPTCA12CA1 | |
| Hydrochloric Acid SCHEMBL4922945 | 0.78 | DRD3 (0.42) | POLBALDH1A1MAPTCA12CA1 | |
| SCHEMBL2470496 | 0.77 | ADRB2 (0.57) | POLBALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL4915819 | 0.76 | ADRB2 (0.56) | POLBALDH1A1MAPT | |
| SCHEMBL2472844 | 0.69 | CNR2 (0.47) | CNR2CNR1POLBNPSR1TSHR |
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 |