Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 10/20 | 0.53 |
| ▸ | CNR1 | P21554 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 2/20 | 0.46 |
| ▸ | BCR | P11274 | 2/20 | 0.46 |
| ▸ | MAP2 | P11137 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | FASN | P49327 | 1/20 | 0.45 |
| ▸ | BTK | Q06187 | 1/20 | 0.45 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL807329 | 0.76 | SCN10A (0.48) | NPC1RAB9A | |
| SCHEMBL807334 | 0.74 | KCNH2 (0.54) | HPGDNPC1RAB9AALDH1A1GRM2 | |
| SCHEMBL3455787 | 0.72 | HPGD (0.80) | HPGDHSD17B10NPC1RAB9AALDH1A1 | |
| SCHEMBL11112400 | 0.72 | HPGD (0.80) | HPGDHSD17B10NPC1RAB9AALDH1A1 | |
| SCHEMBL807328 | 0.71 | KDM4E (0.53) | HPGDNPC1RAB9AMAP2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL4034198 | 0.71 | HPGD (0.77) | HPGDHSD17B10NPC1RAB9AALDH1A1 | |
| SCHEMBL31387921 | 0.71 | HPGD (0.76) | HPGDHSD17B10NPC1RAB9AALDH1A1 | |
| SCHEMBL2290298 | 0.70 | KDM4E (0.45) | HPGDCNR1HSD17B10ALDH1A1 | |
| SCHEMBL790083 | 0.70 | PTGS2 (0.51) | NPC1RAB9A | |
| SCHEMBL789573 | 0.69 | CDC7 (0.40) | CNR1ALDH1A1GRM2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |