Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5505365 | 0.76 | HRH3 (0.34) | — | |
| SCHEMBL5505360 | 0.76 | HRH3 (0.34) | — | |
| SCHEMBL5507418 | 0.75 | HPGD (0.43) | ALDH1A1 | |
| SCHEMBL5500642 | 0.75 | DRD2 (0.43) | ADRA2A | |
| SCHEMBL5501529 | 0.74 | HRH3 (0.32) | — | |
| SCHEMBL5505487 | 0.72 | CYP1A2 (0.45) | CYP1A2ALDH1A1ADRA2A | |
| SCHEMBL5502126 | 0.68 | SIGMAR1 (0.38) | ALDH1A1 | |
| SCHEMBL5504816 | 0.68 | NSD2 (0.35) | — | |
| SCHEMBL14443038 | 0.63 | CYP1A2 (0.50) | CYP1A2ALDH1A1ADRA2A | |
| SCHEMBL14443040 | 0.63 | CYP1A2 (0.50) | CYP1A2ALDH1A1ADRA2A |
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-1847530-A1 | DIAMINE DERIVATIVE | KYOWA HAKKO KOGYO CO., LTD. (JP) | 2007-10-24 | — | — | EP | disclosed |