Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VKORC1 | Q9BQB6 | 3/20 | 0.69 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.58 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.58 |
| ▸ | RELA | Q04206 | 1/20 | 0.58 |
| ▸ | NQO1 | P15559 | 3/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | ALB | P02768 | 1/20 | 0.56 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL310481 | 0.84 | VKORC1 (0.82) | VKORC1NQO1CYP2C9 | |
| SCHEMBL32659670 | 0.84 | VKORC1 (0.82) | VKORC1NQO1CYP2C9 | |
| SCHEMBL7349603 | 0.82 | VKORC1 (1.00) | VKORC1NQO1MEN1KMT2ACYP2C9 | |
| SCHEMBL4958904 | 0.81 | MEN1 (0.57) | NFKB1NFKB2RELANQO1MEN1 | |
| SCHEMBL28761758 | 0.79 | VKORC1 (0.69) | VKORC1NQO1MEN1KMT2ACYP2C9 | |
| SCHEMBL14078661 | 0.78 | NQO1 (0.73) | VKORC1NQO1CYP2C9 | |
| SCHEMBL7349367 | 0.78 | VKORC1 (0.74) | VKORC1NQO1MEN1KMT2ACYP2C9 | |
| SCHEMBL25198895 | 0.77 | VKORC1 (0.58) | VKORC1NQO1MEN1KMT2ACYP2C9 | |
| SCHEMBL6924340 | 0.77 | NQO1 (0.53) | NFKB1NFKB2RELANQO1MEN1 | |
| SCHEMBL9209750 | 0.76 | VKORC1 (0.57) | VKORC1NQO1MEN1KMT2ACYP2C9 |
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-5686486-A | 4-hydroxy-benzopyran-2-ones and 4-hydroxy-cycloalkyl b!pyran-2-ones useful to treat retroviral infections | PHARMACIA & UPJOHN COMPANY (US) | 1997-11-11 | — | — | US | disclosed |