Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 4/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.57 |
| ▸ | RELA | Q04206 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | CA1 | P00915 | 6/20 | 0.56 |
| ▸ | CA2 | P00918 | 6/20 | 0.56 |
| ▸ | CA12 | O43570 | 5/20 | 0.56 |
| ▸ | CA9 | Q16790 | 5/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | NAMPT | P43490 | 1/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1541945 | 0.90 | CA1 (0.64) | ACACBNPC1RAB9ACA1CA2 | |
| SCHEMBL26964370 | 0.89 | CA1 (0.56) | ACACBCA1CA2CA12CA9 | |
| SCHEMBL13907700 | 0.89 | ALDH1A1 (0.68) | ACACBNPC1MAPTCA1CA2 | |
| SCHEMBL27741033 | 0.89 | ACACB (0.59) | ACACBNPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL23291290 | 0.88 | CA1 (0.55) | ACACBNPC1RAB9AMAPTNFKB1 | |
| SCHEMBL23291155 | 0.88 | CA1 (0.55) | ACACBNPC1RAB9AMAPTNFKB1 | |
| SCHEMBL5892281 | 0.88 | CA1 (0.55) | ACACBNPC1RAB9AMAPTNFKB1 | |
| SCHEMBL23291262 | 0.88 | CA1 (0.55) | ACACBNPC1RAB9AMAPTNFKB1 | |
| SCHEMBL31606699 | 0.87 | CA1 (0.54) | CA1CA2CA12CA9LMNA | |
| SCHEMBL4446760 | 0.87 | MEN1 (0.55) | NPC1RAB9AMAPTNFKB1NFKB2 |
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-2017102014-A1 | PROPENAMIDE THIOPHENE DERIVATIVES AS FLAVIVIRUS INHIBITORS AND THEIR USE | UNIVERSITE D'AIX-MARSEILLE (FR) | 2017-06-22 | — | — | WO | disclosed |