Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL2906916 | 0.74 | ALDH1A1 (0.46) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL10025826 | 0.74 | ALDH1A1 (0.50) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL1373429 | 0.74 | HSD17B10 (0.50) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL28650023 | 0.73 | ALDH1A1 (0.44) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL3469400 | 0.72 | CYP1A2 (0.46) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL1373855 | 0.72 | CYP2D6 (0.43) | CYP1A2ERBB2FYNMAOAACHE | |
| Thiophene SCHEMBL1795888 | 0.72 | ALDH1A1 (0.52) | CYP1A2ERBB2FYNMAOAACHE | |
| Thiophene SCHEMBL20518196 | 0.72 | ALDH1A1 (0.52) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL31130596 | 0.72 | ALDH1A1 (0.50) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL21764658 | 0.72 | ALDH1A1 (0.50) | CYP1A2ERBB2FYNMAOAACHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102617834-B | Soluble poly-5,10-phenanthrene thiophene and preparing method and application thereof | UNIV SOUTH CHINA TECH | 2013-09-25 | — | — | CN | disclosed |
| CN-102617834-A | Soluble poly-5,10-phenanthrene thiophene and preparing method and application thereof | UNIV SOUTH CHINA TECH | 2012-08-01 | — | — | CN | disclosed |