Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD274 | Q9NZQ7 | 12/20 | 0.52 |
| ▸ | PDCD1 | Q15116 | 10/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.42 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9379481 | 0.85 | SHMT2 (0.56) | TAAR1SHMT2HTR1AADRA2AADRA2B | |
| SCHEMBL9378209 | 0.80 | SHMT2 (0.46) | CD274TAAR1SHMT2HTR1A | |
| SCHEMBL9379889 | 0.79 | KMT2A (0.49) | CD274PDCD1TAAR1SHMT2HTR1A | |
| SCHEMBL9378235 | 0.79 | SHMT2 (0.42) | TAAR1SHMT2HTR1A | |
| SCHEMBL9379697 | 0.79 | SHMT2 (0.42) | TAAR1SHMT2HTR1A | |
| SCHEMBL9379615 | 0.77 | SHMT2 (0.49) | TAAR1SHMT2HTR1A | |
| SCHEMBL9382490 | 0.76 | SHMT2 (0.43) | TAAR1SHMT2HTR1A | |
| SCHEMBL9377633 | 0.76 | POLB (0.45) | TAAR1SHMT2 | |
| SCHEMBL9379259 | 0.76 | TAAR1 (0.41) | TAAR1SHMT2HTR1A | |
| SCHEMBL9378321 | 0.76 | TAAR1 (0.41) | CD274PDCD1TAAR1SHMT2HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0269030-B1 | Lipid-peroxide formation inhibiting composition and novel compounds useful therefor | MITSUBISHI CHEM IND (JP) | 1994-05-04 | — | — | EP | disclosed |
| US-5089515-A | Antiischemic agents; pyrazolone compounds | MITSUBISHI KASEI CORPORATION (JP) | 1992-02-18 | — | — | US | disclosed |
| US-4990619-A | Cardiovascular disorders, antiischemic agents | MITSUBISHI KASEI CORPORATION (JP) | 1991-02-05 | — | — | US | disclosed |
| US-4906644-A | Lipid-peroxide formation inhibiting composition and novel compounds useful therefor | MITSUBISHI KASEI CORPORATION (JP) | 1990-03-06 | — | — | US | disclosed |