Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.55 |
| ▸ | MAOA | P21397 | 2/20 | 0.55 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.55 |
| ▸ | FYN | P06241 | 1/20 | 0.55 |
| ▸ | ACHE | P22303 | 1/20 | 0.55 |
| ▸ | AHR | P35869 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | NQO2 | P16083 | 2/20 | 0.37 |
| ▸ | NQO1 | P15559 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4525187 | 0.85 | CYP1A2 (0.71) | CYP1A2MAOAERBB2FYNACHE | |
| SCHEMBL11098338 | 0.85 | CYP1A2 (0.56) | CYP1A2MAOAERBB2FYNACHE | |
| SCHEMBL6078514 | 0.81 | CYP1A2 (0.56) | CYP1A2MAOAERBB2FYNACHE | |
| SCHEMBL6754519 | 0.81 | CYP1A2 (0.55) | CYP1A2MAOAERBB2FYNACHE | |
| SCHEMBL5476802 | 0.79 | CYP1A2 (0.63) | CYP1A2MAOAERBB2FYNACHE | |
| SCHEMBL2407961 | 0.79 | ALDH1A1 (0.45) | CYP1A2MAOAERBB2FYNACHE | |
| SCHEMBL29388401 | 0.79 | ALDH1A1 (0.45) | CYP1A2MAOAERBB2FYNACHE | |
| SCHEMBL21409508 | 0.78 | ALDH1A1 (0.44) | CYP1A2MAOAERBB2FYNACHE | |
| SCHEMBL4850380 | 0.78 | CYP1A2 (0.67) | CYP1A2MAOAERBB2FYNACHE | |
| SCHEMBL31336860 | 0.78 | CYP1A2 (0.61) | CYP1A2MAOAERBB2FYNACHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6699594-B1 | Organic electroluminescent device | NEC CORPORATION (JP) | 2004-03-02 | — | — | US | disclosed |
| US-6465116-B1 | 8-(N-4-(4-METHYLPHENYLVINYL)PHENYL-N-P-TOLYLAMINO)-16-(N-PHENYL-N-P -TOLYLA MINO)DIBENZO(A,J)PERYLENE THIN FILMS BETWEEN ANODES AND CATHODES, HAVING BRIGHTNESS AND DURABILITY | NEC CORPORATION (JP) | 2002-10-15 | — | — | US | disclosed |