Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | C3AR1 | Q16581 | 6/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HPGDS | O60760 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 2/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | LONP1 | P36776 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6463773 | 0.83 | DAGLA (0.34) | CYP1A2CYP2C9CYP2C19KMT2ALONP1 | |
| SCHEMBL6465469 | 0.82 | PPARG (0.35) | CYP1A2CYP2C9CYP2C19KMT2ALONP1 | |
| SCHEMBL6465287 | 0.81 | TRPV1 (0.42) | LONP1 | |
| SCHEMBL6463837 | 0.71 | NPSR1 (0.35) | C3AR1HDAC1HDAC8HDAC6HPGDS | |
| SCHEMBL7046400 | 0.70 | PTGER4 (0.38) | HDAC1HDAC8HDAC6NPSR1 | |
| SCHEMBL6467305 | 0.70 | MMP9 (0.44) | C3AR1HDAC1HDAC8HDAC6MMP2 | |
| SCHEMBL6467310 | 0.70 | MMP9 (0.44) | C3AR1HDAC1HDAC8HDAC6MMP2 | |
| SCHEMBL6466256 | 0.70 | MMP9 (0.44) | C3AR1HDAC1HDAC8HDAC6MMP2 | |
| SCHEMBL7466136 | 0.69 | FAAH (0.36) | CYP3A4 | |
| SCHEMBL6466197 | 0.69 | FAAH (0.36) | CYP3A4 |
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-1516877-A1 | Amine derivatives as protease inhibitors | AXYS PHARMACEUTICALS, INC. (US) | 2005-03-23 | — | — | EP | disclosed |