Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 3/20 | 0.56 |
| ▸ | DRD2 | P14416 | 2/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | HTR2B | P41595 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | HTR7 | P34969 | 3/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2706321 | 0.85 | DRD4 (0.59) | DRD4DRD2DRD3HTR2AHTR2C | |
| SCHEMBL1647156 | 0.79 | DRD4 (0.50) | DRD4DRD2DRD3HTR2AHTR2C | |
| SCHEMBL4392263 | 0.79 | DRD4 (0.70) | DRD4DRD2DRD3HTR2AHTR2C | |
| SCHEMBL2597773 | 0.77 | DRD4 (0.72) | DRD4DRD2DRD3HTR2AHTR2C | |
| SCHEMBL5542706 | 0.76 | DRD4 (0.77) | DRD4DRD2DRD3HTR2AHTR2C | |
| SCHEMBL418557 | 0.76 | DRD4 (0.57) | DRD4DRD2DRD3SIGMAR1ALDH1A1 | |
| SCHEMBL1066467 | 0.76 | HTR2A (0.72) | DRD4HTR2AHTR2CHTR2BALDH1A1 | |
| Hydrochloric Acid SCHEMBL4653252 | 0.74 | HTR2A (0.71) | DRD4HTR2AHTR2CHTR2BHTR7 | |
| SCHEMBL6031812 | 0.74 | DRD4 (1.00) | DRD4DRD2DRD3SIGMAR1ALDH1A1 | |
| SCHEMBL9374413 | 0.74 | SIGMAR1 (0.76) | DRD4DRD2DRD3SIGMAR1HTR7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1233961-A2 | METHOD FOR PRODUCING 5-(1-PIPERAZINYL)-BENZOFURAN-2-CARBOXAMIDE BY TRANSITION METAL-CATALYZED AMINATION | MERCK PATENT GmbH (DE) | 2002-08-28 | — | — | EP | disclosed |
| WO-2001040219-A2 | METHOD FOR PRODUCING 5-(1-PIPERAZINYL)-BENZOFURAN-2-CARBOXAMIDE BY TRANSITION METAL-CATALYZED AMINATION | MERCK PATENT GMBH (DE) | 2001-06-07 | — | — | WO | disclosed |