Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | NQO1 | P15559 | 2/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | STAT1 | P42224 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 3/20 | 0.41 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.41 |
| ▸ | AR | P10275 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL237672 | 0.84 | KDM4E (0.54) | NQO1ALDH1A1KDM4EMAPTPOLB | |
| SCHEMBL7141330 | 0.81 | CYP2C9 (0.64) | CYP2C9NQO1EPHX2ALDH1A1KDM4E | |
| SCHEMBL5273533 | 0.77 | CYP2C9 (1.00) | CYP2C9NQO1EPHX2ALDH1A1KDM4E | |
| SCHEMBL5272845 | 0.76 | CYP2C9 (0.76) | CYP2C9NQO1EPHX2ALDH1A1KDM4E | |
| SCHEMBL4579574 | 0.75 | CYP2C9 (0.61) | CYP2C9NQO1EPHX2ALDH1A1KDM4E | |
| SCHEMBL27192968 | 0.72 | ALDH1A1 (0.63) | CYP2C9NQO1EPHX2ALDH1A1KDM4E | |
| SCHEMBL5905798 | 0.69 | CYP2C9 (0.79) | CYP2C9ALDH1A1KDM4EPOLBNPC1 | |
| SCHEMBL3175714 | 0.68 | HSD17B3 (0.72) | NQO1ALDH1A1KDM4EMAPTGAA | |
| SCHEMBL28510435 | 0.67 | NQO1 (0.82) | CYP2C9NQO1ALDH1A1KDM4EMAPT | |
| SCHEMBL18470672 | 0.66 | CYP2C9 (0.55) | CYP2C9NQO1EPHX2ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1095032-B1 | REAGENTS FOR CYP2D FLUORESCENT ASSAY | GENTEST CORP (US) | 2003-12-10 | — | — | EP | disclosed |
| EP-1095032-A1 | NOVEL CYP2D FLUORESCENT ASSAY REAGENTS | GENTEST CORPORATION (US) | 2001-05-02 | — | — | EP | disclosed |
| US-6130342-A | A 2-OXOCHROMAN COMPOUND CONTAINING A QUATERNARY AMINE GROUP | GENTEST CORPORATION (US) | 2000-10-10 | — | — | US | disclosed |
| WO-2000004008-A1 | NOVEL CYP2D FLUORESCENT ASSAY REAGENTS | GENTEST CORPORATION (US) | 2000-01-27 | — | — | WO | disclosed |