Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 4/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2617234 | 0.80 | TAAR1 (0.61) | TAAR1CYP2A6SLC6A4MAOA | |
| SCHEMBL3041534 | 0.80 | TAAR1 (0.44) | TAAR1HTR2AIDO1CYP2A6SLC6A4 | |
| SCHEMBL164716 | 0.80 | TAAR1 (0.61) | TAAR1CYP2A6SLC6A4MAOA | |
| SCHEMBL2617233 | 0.80 | TAAR1 (0.61) | TAAR1CYP2A6SLC6A4MAOA | |
| Hydrochloric Acid SCHEMBL30559541 | 0.78 | TAAR1 (0.59) | TAAR1CYP2A6SLC6A4MAOA | |
| SCHEMBL1177250 | 0.78 | SLC6A4 (0.46) | TAAR1HTR2AIDO1SLC6A4EPHX1 | |
| SCHEMBL5234787 | 0.78 | SLC6A4 (0.46) | TAAR1HTR2AIDO1SLC6A4EPHX1 | |
| Hydrochloric Acid SCHEMBL17674512 | 0.78 | TAAR1 (0.59) | TAAR1CYP2A6SLC6A4MAOA | |
| SCHEMBL24380871 | 0.77 | TAAR1 (0.41) | TAAR1HTR2AIDO1EPHX1 | |
| Bromide SCHEMBL8209117 | 0.77 | CYP1A2 (0.55) | TAAR1HTR2AIDO1CYP2A6SLC6A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1426392-B1 | COMPOSITION FOR OPTICAL MATERIAL | MITSUBISHI GAS CHEMICAL CO (JP) | 2010-02-24 | — | — | EP | 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 |