Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CES2 | O00748 | 2/20 | 0.41 |
| ▸ | CES1 | P23141 | 2/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | AGXT | P21549 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2434424 | 0.86 | ALDH1A1 (0.44) | ALDH1A1CES2CES1CA3CA6 | |
| SCHEMBL5261755 | 0.82 | DDB1 (0.42) | ALDH1A1CES2CES1CA3CA6 | |
| SCHEMBL5531618 | 0.79 | ALDH1A1 (0.42) | ALDH1A1CES2CES1CA3CA6 | |
| SCHEMBL5716211 | 0.79 | DDB1 (0.44) | ALDH1A1CES2CES1CA3CA6 | |
| SCHEMBL13338139 | 0.79 | DDB1 (0.44) | ALDH1A1CES2CES1CA3CA6 | |
| SCHEMBL21279547 | 0.79 | ALDH1A1 (0.42) | ALDH1A1CES2CES1CA3CA6 | |
| SCHEMBL20671377 | 0.79 | ACHE (0.44) | ALDH1A1DDB1CRBNNFE2L2TSHR | |
| SCHEMBL31327835 | 0.79 | DPP4 (0.36) | ALDH1A1CES2CES1CA3CA6 | |
| SCHEMBL14469220 | 0.77 | DDB1 (0.42) | ALDH1A1CES2CES1CA3CA6 | |
| Hydrochloric Acid SCHEMBL31098507 | 0.77 | DDB1 (0.42) | ALDH1A1CES2CES1CA3CA6 |
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 |
|---|---|---|---|---|---|---|---|
| US-7585590-B2 | Rechargeable lithium-ion cell with triphenylamine redox shuttle | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2009-09-08 | — | — | US | disclosed |
| EP-1994600-A2 | RECHARGEABLE LITHIUM-ION CELL WITH TRIPHENYLAMINE REDOX SHUTTLE | 3M Innovative Properties Company (US) | 2008-11-26 | — | — | EP | disclosed |
| WO-2007097912-A2 | RECHARGEABLE LITHIUM-ION CELL WITH TRIPHENYLAMINE REDOX SHUTTLE | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2007-08-30 | — | — | WO | disclosed |
| US-20070196727-A1 | Rechargeable Lithium-Ion Cell with Triphenylamine Redox Shuttle | 3M INNOVATIVE PROPERTIES COMPANY | 2007-08-23 | — | — | US | disclosed |