Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | APP | P05067 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18978244 | 0.88 | S1PR1 (0.36) | S1PR1CYP1A2MAPTALDH1A1KDM4E | |
| SCHEMBL22246993 | 0.87 | S1PR1 (0.35) | S1PR1CYP1A2GAA | |
| SCHEMBL7764813 | 0.86 | CYP2A6 (0.44) | CYP1A2ALDH1A1SIGMAR1CYP2A6 | |
| SCHEMBL10053538 | 0.84 | ALDH1A1 (0.42) | CYP1A2MAPTALDH1A1CYP3A4TDP1 | |
| SCHEMBL10065973 | 0.83 | ALDH1A1 (0.45) | S1PR1CYP1A2MAPTALDH1A1KDM4E | |
| SCHEMBL14163838 | 0.83 | ALDH1A1 (0.48) | S1PR1CYP1A2MAPTALDH1A1KDM4E | |
| SCHEMBL295453 | 0.83 | ALDH1A1 (0.48) | S1PR1CYP1A2MAPTALDH1A1KDM4E | |
| SCHEMBL26280939 | 0.83 | ALDH1A1 (0.48) | S1PR1CYP1A2MAPTALDH1A1KDM4E | |
| SCHEMBL2310644 | 0.83 | ALDH1A1 (0.48) | S1PR1CYP1A2MAPTALDH1A1KDM4E | |
| SCHEMBL1376567 | 0.82 | CYP1A2 (0.38) | S1PR1CYP1A2MAPTALDH1A1CES2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0699654-B1 | Hole-transporting material and use thereof | TOYO INK MFG CO (JP) | 1999-03-31 | — | — | EP | disclosed |
| US-5681664-A | CONTAINING A POLYAMINE | TOYO INK MANUFACTURING CO., LTD. (JP) | 1997-10-28 | — | — | US | disclosed |
| EP-0699654-A1 | Hole-transporting material | TOYO INK MANUFACTURING CO., LTD. (JP) | 1996-03-06 | — | — | EP | disclosed |