Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | PPOX | P50336 | 1/20 | 0.36 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.35 |
| ▸ | S100A4 | P26447 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.34 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TYMS | P04818 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.33 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9588047 | 0.81 | CA1 (0.41) | S100A4MEN1KMT2AALDH1A1 | |
| SCHEMBL9587883 | 0.81 | CA1 (0.41) | KCNE1KCNQ1ALDH1A1 | |
| SCHEMBL9703829 | 0.81 | CA1 (0.41) | KCNE1KCNQ1ALDH1A1 | |
| SCHEMBL9588006 | 0.79 | CA1 (0.46) | HTR2BMEN1KMT2APDK2MAPT | |
| SCHEMBL9588009 | 0.79 | CA1 (0.46) | HTR2BMEN1KMT2APDK2MAPT | |
| SCHEMBL9588183 | 0.78 | ABCC9 (0.40) | MEN1KMT2AKCNE1KCNQ1ABCC9 | |
| SCHEMBL9565113 | 0.78 | ABCC9 (0.40) | MEN1KMT2AKCNE1KCNQ1ABCC9 | |
| SCHEMBL9587885 | 0.77 | L3MBTL1 (0.36) | MEN1KMT2AMAPTALDH1A1THRB | |
| SCHEMBL9588599 | 0.72 | CA1 (0.41) | S100A4MEN1KMT2ACES1MAPT | |
| SCHEMBL9587011 | 0.72 | HTT (0.38) | PPOXS100A4KCNE1KCNQ1CES1 |
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 3 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 |
| EP-0489300-A2 | Tetralones with pharmacological activity | J. URIACH & CIA. S.A. (ES) | 1992-06-10 | — | — | EP | disclosed |