Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | PGR | P06401 | 1/20 | 0.54 |
| ▸ | ESRRA | P11474 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | BLM | P54132 | 2/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.47 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.47 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Alpha-Naphthylacetate SCHEMBL29372782 | 0.89 | ALDH1A1 (0.66) | ALDH1A1HSD17B10GAAPTGS1MAPK1 | |
| Alpha-Naphthylacetate SCHEMBL76633 | 0.89 | ALDH1A1 (0.66) | ALDH1A1HSD17B10GAAPTGS1MAPK1 | |
| Alpha-Naphthylacetate SCHEMBL10751537 | 0.87 | ALDH1A1 (0.64) | ALDH1A1HSD17B10GAAPTGS1MAPK1 | |
| Alpha-Naphthylacetate SCHEMBL10751544 | 0.87 | ALDH1A1 (0.64) | ALDH1A1HSD17B10GAAPTGS1MAPK1 | |
| Alpha-Naphthylacetate SCHEMBL28643889 | 0.87 | ALDH1A1 (0.64) | ALDH1A1HSD17B10GAAPTGS1MAPK1 | |
| Alpha-Naphthylacetate SCHEMBL14715880 | 0.87 | ALDH1A1 (0.64) | ALDH1A1HSD17B10GAAPTGS1MAPK1 | |
| Alpha-Naphthylacetate SCHEMBL11320989 | 0.87 | ALDH1A1 (0.64) | ALDH1A1HSD17B10GAAPTGS1MAPK1 | |
| Alpha-Naphthylacetate SCHEMBL15903555 | 0.87 | ALDH1A1 (0.64) | ALDH1A1HSD17B10GAAPTGS1MAPK1 | |
| Alpha-Naphthylacetate SCHEMBL14715837 | 0.87 | ALDH1A1 (0.64) | ALDH1A1HSD17B10GAAPTGS1MAPK1 | |
| Alpha-Naphthylacetate SCHEMBL14715892 | 0.87 | ALDH1A1 (0.64) | ALDH1A1HSD17B10GAAPTGS1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1492795-A1 | 1- OR 3-THIA-BENZONAPHTHOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PREPARATION THEREOF | PLIVA-ISTRAZIVACKI INSTITUT d.o.o. (HR) | 2005-01-05 | — | — | EP | disclosed |
| WO-2003084961-A1 | 1- OR 3-THIA-BENZONAPHTHOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PREPARATION THEREOF | PLIVA-ISTRAZIVACKI INSTITUT D.O.O. (HR) | 2003-10-16 | — | — | WO | disclosed |