Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | PYCR1 | P32322 | 4/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29178568 | 0.90 | ALDH1A1 (0.48) | ALDH1A1KDM4ETRPA1TSHRMAPT | |
| SCHEMBL7536 | 0.84 | — | — | |
| Bromide SCHEMBL29227177 | 0.82 | ALDH1A1 (0.50) | ALDH1A1KDM4EPYCR1TAAR1TRPA1 | |
| Fluoride SCHEMBL29026731 | 0.82 | ALDH1A1 (0.50) | ALDH1A1KDM4EPYCR1TAAR1TRPA1 | |
| SCHEMBL5389732 | 0.82 | ALDH1A1 (0.50) | ALDH1A1KDM4EPYCR1TAAR1TRPA1 | |
| SCHEMBL23714869 | 0.82 | CYP2A6 (0.57) | ALDH1A1KDM4ETAAR1TSHRHTR2A | |
| SCHEMBL67004 | 0.82 | CYP2A6 (0.57) | ALDH1A1KDM4ETAAR1TSHRHTR2A | |
| SCHEMBL12514357 | 0.81 | TAAR1 (0.45) | ALDH1A1KDM4EPYCR1TAAR1TSHR | |
| SCHEMBL17166204 | 0.81 | TAAR1 (0.45) | ALDH1A1KDM4EPYCR1TAAR1TSHR | |
| SCHEMBL7147284 | 0.81 | ALDH1A1 (0.59) | ALDH1A1KDM4ETRPA1TSHRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-9184388-B2 | Layered structure, electronic device using same, aromatic compound, and method for manufacturing said compound | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2015-11-10 | — | — | US | disclosed |
| US-20130119369-A1 | LAYERED STRUCTURE, ELECTRONIC DEVICE USING SAME, AROMATIC COMPOUND, AND METHOD FOR MANUFACTURING SAID COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-05-16 | — | — | US | disclosed |