Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.49 |
| ▸ | CHIA | Q9BZP6 | 1/20 | 0.46 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.39 |
| ▸ | HTR3B | O95264 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.39 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
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 SCHEMBL9755197 | 0.99 | PARP1 (0.48) | PARP1CHIASLC18A3DRD2HRH3 | |
| SCHEMBL9640183 | 0.85 | SIRT6 (0.47) | PARP1CHIADRD2HTR1AHTR2A | |
| Hydrochloric Acid SCHEMBL9639460 | 0.84 | SIRT6 (0.46) | PARP1CHIADRD2HTR1AHTR2A | |
| SCHEMBL9639544 | 0.83 | PARP1 (0.50) | PARP1CHIADRD2HTR1ADRD4 | |
| SCHEMBL9639591 | 0.82 | PARP1 (0.50) | PARP1CHIADRD4 | |
| Hydrochloric Acid SCHEMBL9640177 | 0.81 | PARP1 (0.49) | PARP1CHIADRD4 | |
| SCHEMBL9755222 | 0.81 | PARP1 (0.52) | PARP1CHIAHTR1A | |
| SCHEMBL9640631 | 0.80 | PARP1 (0.53) | PARP1CHIA | |
| SCHEMBL9639730 | 0.80 | PARP1 (0.48) | PARP1CHIADRD2HTR1AHTR2A | |
| Fumaric Acid SCHEMBL9755189 | 0.79 | PARP1 (0.48) | PARP1CHIADRD4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991006542-A1 | PHARMACEUTICALLY ACTIVE AMINO-SUBSTITUTED HETEROARYL AMINES | THE UPJOHN COMPANY (US) | 1991-05-16 | — | — | WO | claimed |
| EP-0496746-A1 | PHARMACEUTICALLY ACTIVE AMINO-SUBSTITUTED HETEROARYL AMINES | THE UPJOHN COMPANY (US) | 1992-08-05 | — | — | EP | disclosed |
| WO-1991006542-A1 | PHARMACEUTICALLY ACTIVE AMINO-SUBSTITUTED HETEROARYL AMINES | THE UPJOHN COMPANY (US) | 1991-05-16 | — | — | WO | disclosed |