Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | THPO | P40225 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL12859380 | 0.87 | MEN1 (0.40) | PTGS2NPSR1KDM4EALDH1A1RAB9A | |
| SCHEMBL16200053 | 0.83 | SLC34A1 (0.44) | PTGS2PTGS1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL14039900 | 0.81 | ALDH1A1 (0.50) | CYP1A2CYP2C9CYP2C19NPSR1KDM4E | |
| SCHEMBL16200057 | 0.80 | MAPK14 (0.42) | CYP1A2CYP2C9CYP2C19KDM4EALDH1A1 | |
| SCHEMBL14996631 | 0.78 | MEN1 (0.43) | PTGS2NPSR1KDM4EALDH1A1RAB9A | |
| SCHEMBL8108697 | 0.77 | SLC34A1 (0.38) | CYP1A2CYP2C9CYP2C19NPSR1KDM4E | |
| SCHEMBL13739115 | 0.75 | ALDH1A1 (0.55) | NPSR1KDM4EALDH1A1RAB9ANPC1 | |
| SCHEMBL8475975 | 0.74 | F2RL3 (0.38) | PTGS2NPSR1KDM4EALDH1A1RAB9A | |
| SCHEMBL7780377 | 0.74 | PTGS2 (0.56) | PTGS2PTGS1 | |
| SCHEMBL14039556 | 0.73 | NT5E (0.41) | PTGS2CYP1A2CYP3A4TSHRKDM4E |
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-1720545-B1 | BICYCLIC AND BRIDGED NITROGEN HETEROCYCLES | CHEMOCENTRYX INC (US) | 2014-10-29 | — | — | EP | disclosed |