Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 5/20 | 0.43 |
| ▸ | DRD2 | P14416 | 4/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 3/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.40 |
| ▸ | HTR7 | P34969 | 2/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | PHGDH | O43175 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8911693 | 0.81 | TTR (0.47) | ALDH1A1CYP1A2HIF1ADHFRXDH | |
| SCHEMBL8912815 | 0.75 | TSHR (0.57) | DRD4DRD2DRD3KDM4EALDH1A1 | |
| SCHEMBL8912435 | 0.71 | DHFR (0.40) | DHFRXDHNOS1 | |
| SCHEMBL8913183 | 0.71 | DHFR (0.44) | DHFRXDHNOS1 | |
| SCHEMBL3088832 | 0.71 | DRD4 (0.54) | DRD4DRD2DRD3ARHTR1A | |
| SCHEMBL8912802 | 0.69 | SIRT6 (0.50) | ALDH1A1DHFR | |
| SCHEMBL20139817 | 0.68 | RXFP1 (0.52) | DRD4DRD2DRD3ARPHGDH | |
| SCHEMBL20140652 | 0.68 | PHGDH (0.45) | DRD4DRD2DRD3ARHTR1A | |
| SCHEMBL6261764 | 0.68 | DRD4 (0.45) | DRD4DRD2DRD3ARKDM4E | |
| SCHEMBL20139913 | 0.67 | DRD4 (0.47) | DRD4DRD2DRD3ARHTR1A |
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-5670508-A | ANTITUMOR AGENTS FOR BRAIN TUMORS | NATIONAL SCIENCE COUNCIL (TW) | 1997-09-23 | — | — | US | disclosed |