Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 12/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3675447 | 0.88 | TAAR1 (0.39) | TAAR1MAPTNPSR1MAPK1HTR2A | |
| SCHEMBL16053760 | 0.84 | TAAR1 (0.62) | TAAR1MAPTNPSR1MAPK1HTR2A | |
| SCHEMBL726804 | 0.78 | TAAR1 (0.68) | TAAR1MAPTNPSR1MAPK1HTR2A | |
| SCHEMBL3680996 | 0.78 | TAAR1 (0.56) | TAAR1HTR2ASMN1; SMN2HMGB1HRH1 | |
| SCHEMBL21901481 | 0.78 | LIPG (0.39) | — | |
| Hydrochloric Acid SCHEMBL789069 | 0.77 | TAAR1 (0.65) | TAAR1MAPTNPSR1MAPK1HTR2A | |
| SCHEMBL5705869 | 0.77 | TAAR1 (0.61) | TAAR1MAPTNPSR1MAPK1HTR2A | |
| SCHEMBL19504259 | 0.77 | CYP3A4 (0.54) | TAAR1MAPTNPSR1MAPK1HTR2A | |
| SCHEMBL28014244 | 0.76 | LIPG (0.46) | — | |
| SCHEMBL3668720 | 0.76 | TAAR1 (0.44) | TAAR1MAPTNPSR1HTR2ASMN1; SMN2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103664974-A | Aryl [a] indole [2,3-g] quinolizine compound as well as preparation method, pharmaceutical composition and application thereof | SHANGHAI INST MATERIA MEDICA | 2014-03-26 | — | — | CN | disclosed |
| 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 |