Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 5/20 | 0.42 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | RAD52 | P43351 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | NQO2 | P16083 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 2/20 | 0.37 |
| ▸ | CASP7 | P55210 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30534528 | 0.83 | ALDH1A1 (0.44) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL5030388 | 0.83 | ALDH1A1 (0.44) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL29463710 | 0.79 | ALDH1A1 (0.48) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL677653 | 0.79 | ALDH1A1 (0.48) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL31281983 | 0.79 | ALDH1A1 (0.48) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL24703324 | 0.79 | CYP2A6 (0.40) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL13601825 | 0.79 | POLB (0.39) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL13601826 | 0.79 | CYP1A2 (0.45) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL12124161 | 0.77 | ALDH1A1 (0.46) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL10611288 | 0.77 | HTR2A (0.52) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101407493-B | Organic material and use thereof in organic EL device | UNIV TSINGHUA | 2010-07-21 | — | — | CN | disclosed |
| EP-1426392-B1 | COMPOSITION FOR OPTICAL MATERIAL | MITSUBISHI GAS CHEMICAL CO (JP) | 2010-02-24 | — | — | EP | disclosed |
| CN-100556899-C | A kind of electroluminescent organic material and application thereof | TSINGHUA UNIV BEIJING WEIXINNU (CN) | 2009-11-04 | — | — | CN | disclosed |
| CN-101407493-A | Organic material and use thereof in organic EL device | UNIV TSINGHUA (CN) | 2009-04-15 | — | — | CN | disclosed |
| CN-1785984-A | Organic electroluminous material and its application | UNIV TSINGHUA (CN) | 2006-06-14 | — | — | CN | disclosed |
| US-6960640-B2 | Composition for optical material | MITSUBISHI GAS CHEMICAL CO., LTD. (JP) | 2005-11-01 | — | — | US | disclosed |
| US-20040147708-A1 | Composition for optical material | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2004-07-29 | — | — | US | disclosed |
| EP-1426392-A1 | COMPOSITION FOR OPTICAL MATERIAL | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2004-06-09 | — | — | EP | disclosed |