Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 2/20 | 0.36 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.33 |
| ▸ | KCNE1 | P15382 | 3/20 | 0.33 |
| ▸ | KCNQ1 | P51787 | 3/20 | 0.33 |
| ▸ | TGM2 | P21980 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.31 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9703829 | 1.00 | CA1 (0.41) | CA1CA2CA7CA9PGR | |
| SCHEMBL9588047 | 0.81 | CA1 (0.41) | CA1CA2CA7CA9PGR | |
| SCHEMBL9587304 | 0.81 | HTR2B (0.36) | ALDH1A1KCNE1KCNQ1 | |
| SCHEMBL9588006 | 0.79 | CA1 (0.46) | CA1CA2CA7CA9ALDH1A1 | |
| SCHEMBL9588009 | 0.79 | CA1 (0.46) | CA1CA2CA7CA9ALDH1A1 | |
| SCHEMBL9565113 | 0.78 | ABCC9 (0.40) | KDM1AKCNE1KCNQ1 | |
| SCHEMBL9588183 | 0.78 | ABCC9 (0.40) | KDM1AKCNE1KCNQ1 | |
| SCHEMBL9587885 | 0.77 | L3MBTL1 (0.36) | CA1CA2CA7CA9ALDH1A1 | |
| SCHEMBL9589047 | 0.75 | PDK2 (0.41) | PGRALDH1A1 | |
| SCHEMBL9588599 | 0.72 | CA1 (0.41) | CA1CA2CA7CA9PGR |
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 |
|---|---|---|---|---|---|---|---|
| US-5272170-A | Tetralones with pharmacological activity | J. URIACH & CIA., S.A. (ES) | 1993-12-21 | — | — | US | disclosed |
| US-5208246-A | Hypotensive, bronchodilator | J. URIACH & CIA. (ES) | 1993-05-04 | — | — | US | disclosed |