Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 1/20 | 0.52 |
| ▸ | PRKDC | P78527 | 5/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | CGAS | Q8N884 | 1/20 | 0.36 |
| ▸ | GCK | P35557 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL7996801 | 0.92 | PTGES (0.52) | PTGESPRKDCHTR1ADRD2BRD4 | |
| SCHEMBL7996575 | 0.88 | PTGES (0.55) | PTGESPRKDCBRD4IKBKBSGMS2 | |
| SCHEMBL7984832 | 0.88 | PTGES (0.63) | PTGESBRD4SGMS2 | |
| SCHEMBL7994971 | 0.80 | PTGES (0.59) | PTGESPRKDCHTR1ADRD2BRD4 | |
| SCHEMBL7996440 | 0.78 | PTGES (0.54) | PTGESPIK3CDCYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL7984763 | 0.78 | PTGES (0.54) | PTGESALDH1A1POLB | |
| SCHEMBL7984591 | 0.75 | PTGES (0.61) | PTGESALDH1A1POLB | |
| SCHEMBL7996719 | 0.75 | PTGES (0.64) | PTGESPIM1ALDH1A1 | |
| SCHEMBL8339083 | 0.73 | SGMS2 (0.48) | PRKDCHTR1ADRD2BRD4IKBKB | |
| SCHEMBL7994951 | 0.71 | PTGES (0.56) | PTGESALDH1A1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001079209-A2 | DIAZAFLUORENONE IL-8 ANTAGONISTS | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2001-10-25 | — | — | WO | claimed |
| WO-2001079209-A2 | DIAZAFLUORENONE IL-8 ANTAGONISTS | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2001-10-25 | — | — | WO | disclosed |