Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.69 |
| ▸ | LMNA | P02545 | 4/20 | 0.61 |
| ▸ | SLC12A2 | P55011 | 1/20 | 0.61 |
| ▸ | SLC12A5 | Q9H2X9 | 1/20 | 0.61 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.59 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.56 |
| ▸ | CA12 | O43570 | 2/20 | 0.55 |
| ▸ | CA9 | Q16790 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL27670793 | 0.84 | KEAP1 (0.69) | KEAP1LMNASLC12A2SLC12A5HDAC2 | |
| SCHEMBL407414 | 0.82 | KEAP1 (1.00) | KEAP1LMNASLC12A2SLC12A5HDAC2 | |
| SCHEMBL14025561 | 0.82 | KEAP1 (0.71) | KEAP1LMNASLC12A2SLC12A5HDAC2 | |
| SCHEMBL29951672 | 0.81 | KEAP1 (0.65) | KEAP1LMNASLC12A2SLC12A5HDAC2 | |
| SCHEMBL2056065 | 0.81 | KEAP1 (0.65) | KEAP1LMNASLC12A2SLC12A5HDAC2 | |
| SCHEMBL21048461 | 0.81 | KEAP1 (0.81) | KEAP1LMNAHDAC2HDAC8HDAC6 | |
| Hydrochloric Acid SCHEMBL3516799 | 0.81 | KEAP1 (0.96) | KEAP1LMNASLC12A2SLC12A5HDAC2 | |
| SCHEMBL1858605 | 0.81 | KEAP1 (0.69) | KEAP1LMNASLC12A2SLC12A5HDAC2 | |
| SCHEMBL16660687 | 0.81 | ALDH1A1 (0.73) | KEAP1LMNASLC12A2SLC12A5HDAC2 | |
| SCHEMBL31339948 | 0.81 | CYP19A1 (0.85) | KEAP1LMNASLC12A2SLC12A5HDAC2 |
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 3 patents. 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 |
| EP-0682663-A1 | 4-HYDROXY-BENZOPYRAN-2-ONES AND 4-HYDROXY-CYCLOALKYL B]PYRAN-2-ONES USEFUL TO TREAT RETROVIRAL INFECTIONS | PHARMACIA & UPJOHN COMPANY (US) | 1995-11-22 | — | — | EP | disclosed |
| WO-1994018188-A1 | 4-HYDROXY-BENZOPYRAN-2-ONES AND 4-HYDROXY-CYCLOALKYL[B]PYRAN-2-ONES USEFUL TO TREAT RETROVIRAL INFECTIONS | THE UPJOHN COMPANY (US) | 1994-08-18 | — | — | WO | disclosed |