Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6866809 | 0.82 | CYP1A2 (0.44) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL20639561 | 0.75 | KDM4E (0.33) | CYP1A2 | |
| SCHEMBL6864962 | 0.72 | ALDH1A1 (0.46) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL5012545 | 0.67 | GRM5 (0.49) | CYP1A2GRM5 | |
| SCHEMBL12405322 | 0.66 | KDM4E (0.39) | CYP1A2GRM5 | |
| SCHEMBL2367248 | 0.66 | — | — | |
| SCHEMBL2368368 | 0.66 | — | — | |
| SCHEMBL26259699 | 0.66 | ALDH1A1 (0.39) | CYP1A2GRM5 | |
| SCHEMBL17856237 | 0.66 | CYP1A2 (0.42) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL26259569 | 0.66 | CYP1A2 (0.41) | CYP1A2GRM5 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102584851-B | Organic semiconductor compound and polymer and include its transistor and electronic device | 三星电子株式会社 | 2016-06-29 | — | — | CN | disclosed |