Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | LTC4S | Q16873 | 1/20 | 0.32 |
| ▸ | PHGDH | O43175 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | RORA | P35398 | 1/20 | 0.30 |
| ▸ | RORC | P51449 | 1/20 | 0.30 |
| ▸ | RORB | Q92753 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14946149 | 0.82 | BCHE (0.35) | ADRA2APGRRORARORCRORB | |
| SCHEMBL10114767 | 0.82 | MAPT (0.41) | ALDH1A1PGRRORARORCRORB | |
| SCHEMBL10114699 | 0.76 | MEN1 (0.46) | CYP1A2ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL16945418 | 0.71 | LMNA (0.42) | ALDH1A1ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL15960966 | 0.67 | HPGD (0.46) | CYP1A2ALDH1A1CYP2C9CYP2C19ADRA2A | |
| SCHEMBL2992858 | 0.66 | SLC6A4 (0.53) | CYP1A2ALDH1A1CYP2C9CYP2C19ADRA2A | |
| SCHEMBL28931321 | 0.66 | SLC6A4 (0.53) | CYP1A2ALDH1A1CYP2C9CYP2C19ADRA2A | |
| SCHEMBL2998678 | 0.66 | ALDH1A1 (0.60) | CYP1A2ALDH1A1CYP2C9CYP2C19ADRA2A | |
| SCHEMBL16303831 | 0.66 | BCHE (0.50) | ALDH1A1PHGDHTSHRPGRRORA | |
| SCHEMBL20173213 | 0.65 | KDM4E (0.46) | CYP1A2ALDH1A1CYP2C9CYP2C19ADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-20130122710-A1 | CARBAZOLE NOVOLAK RESIN | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2013-05-16 | — | — | US | disclosed |