Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 7/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.67 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.59 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.53 |
| ▸ | TDO2 | P48775 | 1/20 | 0.52 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL21110859 | 1.00 | CYP2A6 (0.67) | CYP2A6ALDH1A1CYP3A4CYP1A2PTGS2 | |
| SCHEMBL20541087 | 0.97 | CYP2A6 (0.70) | CYP2A6ALDH1A1CYP3A4CYP1A2PTGS2 | |
| SCHEMBL30026143 | 0.97 | CYP2A6 (0.70) | CYP2A6ALDH1A1CYP3A4CYP1A2PTGS2 | |
| SCHEMBL31017586 | 0.93 | CYP2A6 (0.64) | CYP2A6ALDH1A1CYP3A4CYP1A2PTGS2 | |
| SCHEMBL4621666 | 0.93 | CYP2A6 (0.64) | CYP2A6ALDH1A1CYP3A4CYP1A2PTGS2 | |
| SCHEMBL29543420 | 0.91 | CYP2A6 (0.61) | CYP2A6ALDH1A1CYP3A4CYP1A2PTGS2 | |
| SCHEMBL472043 | 0.91 | CYP2A6 (0.61) | CYP2A6ALDH1A1CYP3A4CYP1A2PTGS2 | |
| SCHEMBL30685993 | 0.89 | CYP2A6 (0.54) | CYP2A6ALDH1A1CYP3A4CYP1A2PTGS2 | |
| SCHEMBL30685995 | 0.89 | CYP2A6 (0.54) | CYP2A6ALDH1A1CYP3A4CYP1A2PTGS2 | |
| SCHEMBL472037 | 0.89 | CYP2A6 (0.58) | CYP2A6ALDH1A1CYP3A4CYP1A2PTGS2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120298979-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | UDC IRELAND LIMITED (IE) | 2012-11-29 | — | — | US | disclosed |
| US-20120298979-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | UDC IRELAND LIMITED (IE) | 2012-11-29 | — | — | US | disclosed |
| US-8277954-B2 | Light emitting compound; high luminescence efficiency; durability | FUJIFILM CORPORATION (JP) | 2012-10-02 | — | — | US | disclosed |
| US-8277954-B2 | Light emitting compound; high luminescence efficiency; durability | FUJIFILM CORPORATION (JP) | 2012-10-02 | — | — | US | disclosed |
| US-20070196692-A1 | Organic electroluminescent device | FUJIFILM CORPORATION (JP) | 2007-08-23 | — | — | US | disclosed |
| US-20070196692-A1 | Organic electroluminescent device | FUJIFILM CORPORATION (JP) | 2007-08-23 | — | — | US | disclosed |