Known targets — ChEMBL curated mechanism
ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D
The experimentally established mechanism targets of Benzoquinone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLRA1 | P23415 | 1/20 | 0.59 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.59 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.59 |
| ▸ | BLM | P54132 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | RECQL | P46063 | 2/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | APEX1 | P27695 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.47 |
| ▸ | DHODH | Q02127 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | GABRR1 | P24046 | 4/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Succinic Acid SCHEMBL7413466 | 0.79 | LMNA (0.56) | OR51E2BLMALDH1A1RECQLBCHE | |
| Benzene SCHEMBL7131871 | 0.77 | GLRA1 (0.83) | GLRA1SLC6A9OR51E2BLMALDH1A1 | |
| Benzoquinone SCHEMBL31055608 | 0.77 | ALDH1A1 (0.67) | BLMALDH1A1RECQLBCHEPOLB | |
| Glycine SCHEMBL2116443 | 0.77 | — | — | |
| Glycine SCHEMBL6675874 | 0.77 | GLRA1 (1.00) | GLRA1SLC6A9OR51E2BLMALDH1A1 | |
| Glycine SCHEMBL391786 | 0.77 | GLRA1 (1.00) | GLRA1SLC6A9OR51E2BLMALDH1A1 | |
| Glycine SCHEMBL3640989 | 0.77 | GLRA1 (1.00) | GLRA1SLC6A9OR51E2BLMALDH1A1 | |
| Glycine SCHEMBL93765 | 0.77 | GLRA1 (1.00) | GLRA1SLC6A9OR51E2BLMALDH1A1 | |
| Glycine SCHEMBL391027 | 0.77 | GLRA1 (1.00) | GLRA1SLC6A9OR51E2BLMALDH1A1 | |
| Glycine SCHEMBL6163 | 0.77 | — | — |
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-4925921-A | CROSSLINKING WITH BENZOQUINONE; MEDICAL DIAGNOSIS | ETABLISSEMENT DECLARE D'UTILITE PUBLIQUE DIT. INSTITUT PASTEUR (FR) | 1990-05-15 | — | — | US | disclosed |
| US-4592998-A | Using benzoquinone crosslinking agent | ETABLISSEMENT DECLARE D'UTILITE PUBLIQUE DIT: INSTITUT PASTEUR (FR) | 1986-06-03 | — | — | US | disclosed |
| US-4193982-A | BENZOQUINONE AS CROSSLINKING AGENT USED IN LARGE EXCESS | ETABLISSEMENT DECLARE D'UTILITE PUBLIQUE DIT: INSTITUT PASTEUR (FR) | 1980-03-18 | — | — | US | disclosed |