Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 2/20 | 0.38 |
| ▸ | TLR4 | O00206 | 1/20 | 0.37 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 2/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | HSF1 | Q00613 | 1/20 | 0.36 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6466172 | 0.88 | FAAH (0.36) | XDHFAAHCES1HSF1LMNA | |
| SCHEMBL6465186 | 0.87 | ALDH1A1 (0.44) | XDHFAAHCES1HSF1LMNA | |
| SCHEMBL7043202 | 0.80 | P2RY14 (0.37) | XDHTLR4NLRP3CYP1A2CYP3A4 | |
| SCHEMBL6462828 | 0.80 | CTSS (0.41) | XDHCYP3A4 | |
| SCHEMBL6464421 | 0.79 | ALDH1A1 (0.44) | XDHFAAHCES1KDM4ERAB9A | |
| SCHEMBL6464404 | 0.79 | DAGLA (0.48) | XDHFAAHCES1ALDH1A1PPARG | |
| SCHEMBL14110504 | 0.79 | FAAH (0.51) | XDHFAAHCES1HSF1KDM4E | |
| SCHEMBL6467430 | 0.77 | P2RY14 (0.35) | XDHTLR4NLRP3CYP1A2CYP3A4 | |
| SCHEMBL6465108 | 0.76 | XDH (0.39) | XDHFAAHCES1HSF1KDM4E | |
| SCHEMBL7043205 | 0.75 | CTSS (0.39) | XDHCYP3A4P2RY14 |
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 |