Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.39 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.39 |
| ▸ | SLC1A3 | P43003 | 3/20 | 0.38 |
| ▸ | SLC1A2 | P43004 | 3/20 | 0.38 |
| ▸ | SLC1A1 | P43005 | 3/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MLYCD | O95822 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL2499273 | 0.90 | HSD11B1 (0.40) | ALOX5SLC1A3SLC1A2SLC1A1HSD11B1 | |
| SCHEMBL1327157 | 0.85 | EPHX1 (0.50) | ALOX5EPHX1HPGDKMT2ASLC1A3 | |
| SCHEMBL29291470 | 0.85 | EPHX1 (0.50) | ALOX5EPHX1HPGDKMT2ASLC1A3 | |
| SCHEMBL29291474 | 0.85 | EPHX1 (0.50) | ALOX5EPHX1HPGDKMT2ASLC1A3 | |
| SCHEMBL24986 | 0.85 | EPHX1 (0.50) | ALOX5EPHX1HPGDKMT2ASLC1A3 | |
| SCHEMBL20379771 | 0.85 | EPHX1 (0.50) | ALOX5EPHX1HPGDKMT2ASLC1A3 | |
| Hydrochloric Acid SCHEMBL6921995 | 0.83 | EPHX1 (0.48) | ALOX5EPHX1HPGDKMT2ASLC1A3 | |
| SCHEMBL8915603 | 0.83 | EPHX1 (0.48) | ALOX5EPHX1HPGDKMT2ASLC1A3 | |
| Water SCHEMBL28513313 | 0.83 | EPHX1 (0.48) | ALOX5EPHX1HPGDKMT2ASLC1A3 | |
| Hydrochloric Acid SCHEMBL27773169 | 0.83 | EPHX1 (0.48) | ALOX5EPHX1HPGDKMT2ASLC1A3 |
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-1377567-B1 | QUINOLINE-4-CARBOXAMIDE DERIVATIVES AS NK-3 AND NK-2 RECEPTOR ANTAGONISTS | GLAXOSMITHKLINE SPA (IT) | 2005-12-21 | — | — | EP | claimed |