Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 9/20 | 0.59 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.59 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.46 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | DRD5 | P21918 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1509692 | 0.86 | HRH3 (0.60) | HRH3KCNH2CYP3A4CYP2C9ESR2 | |
| SCHEMBL1509691 | 0.86 | HRH3 (0.60) | HRH3KCNH2CYP3A4CYP2C9ESR2 | |
| SCHEMBL15584123 | 0.85 | HRH3 (0.49) | HRH3KCNH2CYP3A4CYP2C9ESR2 | |
| SCHEMBL10654074 | 0.85 | HRH3 (0.59) | HRH3KCNH2CYP3A4CYP2C9RAB9A | |
| SCHEMBL10453972 | 0.85 | HRH3 (0.59) | HRH3KCNH2CYP3A4CYP2C9RAB9A | |
| SCHEMBL4089076 | 0.83 | HRH3 (0.63) | HRH3KCNH2CYP3A4CYP2C9ESR2 | |
| SCHEMBL4089073 | 0.83 | HRH3 (0.63) | HRH3KCNH2CYP3A4CYP2C9ESR2 | |
| SCHEMBL11831277 | 0.83 | HRH3 (0.63) | HRH3KCNH2CYP3A4CYP2C9ESR2 | |
| SCHEMBL14973475 | 0.80 | CYP2C9 (0.50) | HRH3KCNH2CYP3A4CYP2C9RAB9A | |
| SCHEMBL20390039 | 0.80 | CYP2C9 (0.50) | HRH3KCNH2CYP3A4CYP2C9RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-7416682-B2 | Photochromic liquid crystals | CHI MEI OPTOELECTRONICS CORPORATION (TW) | 2008-08-26 | — | — | US | disclosed |
| EP-1517977-B1 | PHOTOCHROMIC LIQUID CRYSTALS | QINETIQ LTD (GB) | 2006-10-11 | — | — | EP | disclosed |
| US-20050258396-A1 | Potochromic liquid crystals | QINETIQ LIMITED (GB) | 2005-11-24 | — | — | US | disclosed |
| EP-1517977-A1 | PHOTOCHROMIC LIQUID CRYSTALS | Qinetiq Limited (GB) | 2005-03-30 | — | — | EP | disclosed |
| WO-2004003107-A1 | POTOCHROMIC LIQUID CRYSTALS | QINETIQ LIMITED (GB) | 2004-01-08 | — | — | WO | disclosed |