Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ADH1B | P00325 | 1/20 | 0.41 |
| ▸ | ADH1C | P00326 | 1/20 | 0.41 |
| ▸ | ADH1A | P07327 | 1/20 | 0.41 |
| ▸ | ADH7 | P40394 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | CTSL | P07711 | 3/20 | 0.37 |
| ▸ | CTSB | P07858 | 3/20 | 0.37 |
| ▸ | CTSK | P43235 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8059353 | 0.98 | ADRB2 (0.50) | ADRB2HTTALDH1A1ADH1BADH1C | |
| SCHEMBL8407070 | 0.85 | ADH1B (0.38) | ADRB2HTTALDH1A1ADH1BADH1C | |
| SCHEMBL8410334 | 0.81 | ALDH1A1 (0.39) | ADRB2HTTALDH1A1ADH1BADH1C | |
| SCHEMBL16249350 | 0.79 | LMNA (0.38) | ADRB2HTTALDH1A1EPHX1LMNA | |
| SCHEMBL14285983 | 0.76 | ADRB2 (0.48) | ADRB2HTTALDH1A1MAOAMAOB | |
| SCHEMBL3618445 | 0.74 | ADRB2 (0.65) | ADRB2HTTALDH1A1MAOAMAOB | |
| SCHEMBL13075727 | 0.72 | MAOA (0.45) | ADRB2HTTALDH1A1MAOAMAOB | |
| SCHEMBL28528939 | 0.72 | MAOA (0.45) | ADRB2HTTALDH1A1ADH1BADH1C | |
| SCHEMBL22267932 | 0.71 | ADRB2 (0.48) | ADRB2HTTALDH1A1MAOAMAOB | |
| SCHEMBL20104761 | 0.71 | ADRB2 (0.48) | ADRB2HTTALDH1A1MAOAMAOB |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0532027-B1 | Cyclic nitrones, their preparation and pharmaceutical compositions containing them | MERRELL PHARMA INC (US) | 2000-07-12 | — | — | EP | disclosed |
| US-5677315-A | SPIN TRAPPING AGENTS; USED FOR THE TREATMENT OF OXIDATIVE TISSUE DAMAGE; INTERLEUKIN-1 INHIBITOR; ADMINISTERING | MERRELL PHARMACEUTICALS INC. (US) | 1997-10-14 | — | — | US | disclosed |
| US-5532252-A | FOR THE TREATMENT OF TISSUE DAMAGE ASSOCIATED WITH PHYSICAL TRAUMA | MERRELL PHARMACEUTICALS INC. (US) | 1996-07-02 | — | — | US | disclosed |
| US-5527812-A | PREVENTION OF OXIDATION TISSUE DAMAGE | MERRELL PHARMACEUTICALS INC. (US) | 1996-06-18 | — | — | US | disclosed |
| US-5525615-A | CARDIOVASCULAR DISORDERS | MERRELL PHARMACEUTICALS INC. (US) | 1996-06-11 | — | — | US | disclosed |
| US-5498778-A | BY PREVENTING FREE RADICAL OXYGEN OXIDATION | MERRELL DOW PHARMACEUTICALS INC. (US) | 1996-03-12 | — | — | US | disclosed |
| US-5397789-A | Administering to release interleukin to prevent oxidative tissue damage from free radicals | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-03-14 | — | — | US | disclosed |
| US-5292746-A | Cyclic nitrones, pharmaceutical compositions thereof and their use in treating shock | MERRELL DOW PHARMACEUTICALS INC. (US) | 1994-03-08 | — | — | US | disclosed |
| EP-0532027-A1 | Cyclic nitrones, their preparation and pharmaceutical compositions containing them | MERRELL PHARMACEUTICALS INC. (US) | 1993-03-17 | — | — | EP | disclosed |