Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 8/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.39 |
| ▸ | TTPA | P49638 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8137036 | 0.86 | ALOX5 (0.44) | ALOX5MAOBMAPTMEN1KMT2A | |
| SCHEMBL8116810 | 0.82 | CYP4F2 (0.49) | CYP4F2ALOX5PTGS1PTGS2CYP1A2 | |
| SCHEMBL8131655 | 0.82 | PTGS1 (0.52) | MAOBPTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL8131088 | 0.76 | PTGS1 (0.49) | CYP4F2ALOX5MAOBPTGS1PTGS2 | |
| SCHEMBL9313974 | 0.69 | CYP3A4 (0.49) | CYP4F2ALOX5PTGS1PTGS2CYP1A2 | |
| SCHEMBL18933886 | 0.69 | MAPT (0.55) | CYP4F2ALOX5PTGS1PTGS2CYP1A2 | |
| SCHEMBL8129061 | 0.69 | MAOB (0.45) | MAOB | |
| SCHEMBL8102697 | 0.69 | MAOB (0.51) | MAOBMEN1KMT2ACYP2C9CYP2C19 | |
| SCHEMBL9513053 | 0.69 | MAOB (0.51) | MAOBCYP2C9CYP2C19 | |
| SCHEMBL8119213 | 0.69 | KDM4E (0.38) | ALOX5MAOBPTGS1PTGS2CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1006108-A1 | 3-Hydroxy-2(1H)-pyridinone or 3-hydroxy-4(1H)-pyridinone derivatives useful as reactive oxygen species (ROS) scavengers | Cerebrus Pharmaceuticals Limited (GB) | 2000-06-07 | — | — | EP | disclosed |