Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | RPS6KB2 | Q9UBS0 | 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 | |
|---|---|---|---|---|
| SCHEMBL9936961 | 0.85 | PABPC1 (0.39) | PIM1CES1ALDH1A1HPGDTSHR | |
| SCHEMBL9937173 | 0.78 | PABPC1 (0.43) | PIM1CES1NQO2ALDH1A1HPGD | |
| SCHEMBL9936772 | 0.72 | CES1 (0.39) | PIM1CES1NQO2ALDH1A1HPGD | |
| SCHEMBL186912 | 0.72 | CES1 (0.42) | CES1NQO2ALDH1A1HPGDTSHR | |
| SCHEMBL29663912 | 0.72 | CES1 (0.42) | CES1NQO2ALDH1A1HPGDTSHR | |
| SCHEMBL19742067 | 0.71 | KDM4E (0.39) | ALDH1A1HPGDTSHRMAPK1HSD17B10 | |
| SCHEMBL2389040 | 0.70 | CES1 (0.41) | CES1NQO2ALDH1A1HPGDTSHR | |
| SCHEMBL20657064 | 0.70 | CES1 (0.41) | CES1ALDH1A1HPGDTSHRMAPK1 | |
| Anthracene SCHEMBL28247073 | 0.70 | CES1 (0.41) | PIM1CES1NQO2ALDH1A1HPGD | |
| SCHEMBL29726009 | 0.66 | ALDH1A1 (0.40) | PIM1NQO2ALDH1A1HPGDMAPK1 |
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-2675800-A1 | FUNCTIONALIZED ANTHRACENE-CAPPED OLIGOTHIOPHENES AND ORGANIC SEMICONDUCTORS BASED ON THE SAME, USE THEREOF | Institute Of Chemistry, Chinese Academy Of Sciences (CN) | 2013-12-25 | — | — | EP | disclosed |
| WO-2012079545-A1 | FUNCTIONALIZED ANTHRACENE-CAPPED OLIGOTHIOPHENES AND ORGANIC SEMICONDUCTORS BASED ON THE SAME, USE THEREOF | CHINESE ACADEMY OF SCIENCE INSTITUTE OF CHEMISTRY (CN) | 2012-06-21 | — | — | WO | disclosed |