Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | AHR | P35869 | 2/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.35 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3671771 | 0.87 | CYP1A2 (0.40) | CYP1A2ALDH1A1HSD17B10HPGDAHR | |
| SCHEMBL6838128 | 0.83 | ALDH1A1 (0.46) | CYP1A2ALDH1A1HSD17B10HPGDAHR | |
| SCHEMBL1312172 | 0.81 | ALDH1A1 (0.44) | CYP1A2ALDH1A1HSD17B10HPGDAHR | |
| SCHEMBL27465326 | 0.81 | ALDH1A1 (0.50) | CYP1A2ALDH1A1HSD17B10HPGDAHR | |
| SCHEMBL31257785 | 0.79 | ALDH1A1 (0.43) | CYP1A2ALDH1A1HSD17B10HPGDAHR | |
| SCHEMBL2710690 | 0.78 | HSD17B1 (0.39) | CYP1A2ALDH1A1HSD17B10HPGDHPRT1 | |
| SCHEMBL5179135 | 0.78 | ALDH1A1 (0.45) | CYP1A2ALDH1A1HSD17B10HPGDAHR | |
| SCHEMBL2580469 | 0.76 | ALDH1A1 (0.44) | CYP1A2ALDH1A1HSD17B10HPGDAHR | |
| SCHEMBL29093545 | 0.76 | ESR1 (0.33) | ALDH1A1HSD17B10HPRT1HIF1ACYP1B1 | |
| SCHEMBL27834497 | 0.76 | ALDH1A1 (0.44) | CYP1A2ALDH1A1HSD17B10HPGDAHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2445987-A1 | BLUE/VIOLET DIPHENYLANTHRACENE CHEMILUMINESCENT FLUORESCERS | Cyalume Technologies, Inc (US) | 2012-05-02 | — | — | EP | disclosed |
| WO-2010151654-A1 | BLUE/VIOLET DIPHENYLANTHRACENE CHEMILUMINESCENT FLUORESCERS | CYALUME TECHNOLOGIES, INC. (US) | 2010-12-29 | — | — | WO | disclosed |