Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 1/20 | 0.54 |
| ▸ | TAAR1 | Q96RJ0 | 7/20 | 0.51 |
| ▸ | HTR2A | P28223 | 2/20 | 0.51 |
| ▸ | HTR2C | P28335 | 2/20 | 0.51 |
| ▸ | MPO | P05164 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | HTR1D | P28221 | 1/20 | 0.51 |
| ▸ | HTR1B | P28222 | 1/20 | 0.51 |
| ▸ | HTR7 | P34969 | 1/20 | 0.51 |
| ▸ | CTSK | P43235 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 1/20 | 0.51 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29200232 | 0.90 | BCHE (0.51) | BCHEACHETAAR1HTR2AHTR2C | |
| SCHEMBL9999596 | 0.85 | BCHE (0.57) | BCHEACHEMAPTIMPDH2IMPDH1 | |
| SCHEMBL2311119 | 0.82 | IMPDH2 (0.55) | BCHEACHEMAPTIMPDH2IMPDH1 | |
| SCHEMBL6009655 | 0.82 | BCHE (0.58) | BCHEACHECYP3A4CYP2D6MAPT | |
| SCHEMBL29475607 | 0.82 | BCHE (0.58) | BCHEACHECYP3A4CYP2D6MAPT | |
| SCHEMBL12500019 | 0.79 | IMPDH2 (0.60) | BCHEACHEMAPTIMPDH2IMPDH1 | |
| SCHEMBL31287843 | 0.79 | BCHE (0.55) | BCHEACHECYP1A2CYP3A4CYP2D6 | |
| SCHEMBL30131116 | 0.79 | MAPT (0.67) | TAAR1HTR2AHTR2CMPOCYP1A2 | |
| SCHEMBL195190 | 0.79 | MAPT (0.67) | TAAR1HTR2AHTR2CMPOCYP1A2 | |
| SCHEMBL7480548 | 0.78 | BCHE (0.50) | BCHEACHEMAPTIMPDH2IMPDH1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012014898-A1 | LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT | 日産化学工業株式会社 (JP) | 2012-02-02 | — | — | WO | disclosed |