Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 6/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.58 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.58 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.58 |
| ▸ | VKORC1 | Q9BQB6 | 6/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL8808518 | 0.89 | NQO1 (0.61) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL5072364 | 0.89 | NQO1 (0.71) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL8806732 | 0.86 | NQO1 (0.71) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL8807268 | 0.85 | NQO1 (0.60) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL8806304 | 0.85 | NQO1 (0.69) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL8806699 | 0.85 | NQO1 (0.52) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL9210044 | 0.84 | NQO1 (0.58) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL8945547 | 0.84 | NQO1 (0.55) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL9210230 | 0.84 | VKORC1 (0.76) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL7352875 | 0.81 | VKORC1 (0.58) | NQO1MEN1ABCB11ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-6169181-B1 | HUMAN IMMUNODEFICIENCY VIRUS PROTEINASE INHIBITORS | PHARMACIA & UPJOHN COMPANY | 2001-01-02 | — | — | US | disclosed |
| US-5852195-A | Pyranone compounds useful to treat retroviral infections | PHARMACIA & UPJOHN COMPANY (US) | 1998-12-22 | — | — | US | disclosed |
| EP-0758327-A1 | PYRANONE COMPOUNDS USEFUL TO TREAT RETROVIRAL INFECTIONS | PHARMACIA & UPJOHN COMPANY (US) | 1997-02-19 | — | — | EP | disclosed |
| WO-1995030670-A2 | PYRANONE COMPOUNDS USEFUL TO TREAT RETROVIRAL INFECTIONS | PHARMACIA & UPJOHN COMPANY (US) | 1995-11-16 | — | — | WO | disclosed |