Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.46 |
| ▸ | RORC | P51449 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | SCD | O00767 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL790083 | 0.85 | PTGS2 (0.51) | MEN1NPC1RAB9AKMT2ACHRNA7 | |
| SCHEMBL807030 | 0.80 | MEN1 (0.39) | MEN1NPC1RAB9AKMT2AMAP4K4 | |
| SCHEMBL791451 | 0.76 | MKNK1 (0.42) | JAK2CYP1A2CYP3A4CYP2C9MAP4K4 | |
| SCHEMBL807329 | 0.73 | SCN10A (0.48) | MEN1NPC1RAB9AKMT2AMAP4K4 | |
| SCHEMBL807332 | 0.72 | DHFR (0.37) | MEN1NPC1RAB9AKMT2AMAP4K4 | |
| SCHEMBL789599 | 0.72 | PI4KA (0.52) | MAP4K4KCNH2 | |
| SCHEMBL789814 | 0.72 | PIK3CG (0.53) | — | |
| SCHEMBL10277282 | 0.72 | PIK3CG (0.48) | RORCKCNH2 | |
| SCHEMBL16192761 | 0.72 | PTGDR2 (0.58) | PTGDR2RORCGAAPTGS1PTGS2 | |
| SCHEMBL796868 | 0.71 | PIK3CG (0.60) | — |
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-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |
| WO-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |