Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 7/20 | 0.48 |
| ▸ | NQO1 | P15559 | 3/20 | 0.48 |
| ▸ | VKORC1 | Q9BQB6 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALB | P02768 | 1/20 | 0.46 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9210173 | 0.80 | NQO1 (0.61) | CYP2C9NQO1VKORC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL8945506 | 0.79 | NQO1 (0.53) | CYP2C9NQO1VKORC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL8945552 | 0.79 | NQO1 (0.58) | CYP2C9NQO1VKORC1ALDH1A1KDM4E | |
| SCHEMBL9206009 | 0.78 | NQO1 (0.66) | CYP2C9NQO1VKORC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL7356446 | 0.75 | CYP2C9 (0.72) | CYP2C9NQO1VKORC1ALDH1A1HSD17B10 | |
| SCHEMBL7358731 | 0.74 | NQO1 (0.65) | CYP2C9NQO1VKORC1ALDH1A1HSD17B10 | |
| SCHEMBL8945249 | 0.73 | NQO1 (0.47) | CYP2C9NQO1VKORC1ALDH1A1HSD17B10 | |
| SCHEMBL7351018 | 0.72 | NQO1 (0.61) | CYP2C9NQO1VKORC1ALDH1A1HSD17B10 | |
| SCHEMBL7356247 | 0.71 | NQO1 (0.76) | CYP2C9NQO1VKORC1ALDH1A1HSD17B10 | |
| SCHEMBL7354556 | 0.70 | CYP2C9 (0.69) | CYP2C9NQO1VKORC1ALDH1A1HSD17B10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5510375-A | VIRICIDES TREATING INFECTION CAUSED BY HUMAN IMMUNODEFICIENCY VIRUS AND AIDS | WARNER-LAMBERT COMPANY (US) | 1996-04-23 | — | — | US | disclosed |