Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 10/20 | 0.49 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GUCY1B2 | O75343 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | GUCY1A2 | P33402 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.43 |
| ▸ | GUCY1B1 | Q02153 | 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 | |
|---|---|---|---|---|
| Maleic Acid SCHEMBL9232346 | 0.92 | HRH3 (0.46) | HRH3CXCR1CYP1A2CYP2D6ADRA1A | |
| Fumaric Acid SCHEMBL9232352 | 0.92 | HRH3 (0.46) | HRH3CXCR1CYP1A2CYP2D6ADRA1A | |
| SCHEMBL9234490 | 0.85 | GSK3B (0.50) | HRH3CXCR1CYP1A2CYP2D6KDM4E | |
| SCHEMBL9876899 | 0.85 | CXCR1 (0.45) | HRH3CXCR1CYP1A2CYP2D6LSS | |
| SCHEMBL9876863 | 0.83 | ACHE (0.41) | HRH3CXCR1CYP1A2CYP2D6KDM4E | |
| SCHEMBL9876938 | 0.82 | LSS (0.45) | HRH3CXCR1CYP1A2CYP2D6KDM4E | |
| SCHEMBL9224007 | 0.82 | LSS (0.44) | HRH3CXCR1CYP1A2CYP2D6KDM4E | |
| SCHEMBL9876697 | 0.81 | LSS (0.43) | HRH3CYP1A2CYP2D6KDM4ELSS | |
| SCHEMBL9234584 | 0.81 | LSS (0.46) | HRH3CXCR1KDM4ELSSALDH1A1 | |
| SCHEMBL9877732 | 0.80 | ALDH1A1 (0.53) | HRH3KDM4ELSSALDH1A1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5006520-A | Antibiotics, antitumor agents, treatment of blood disorders | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1991-04-09 | — | — | US | disclosed |