Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | CASR | P41180 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8220424 | 0.76 | ALDH1A1 (0.46) | ALDH1A1CA1CA2PTGS2CYP19A1 | |
| SCHEMBL10651652 | 0.70 | ALDH1A1 (0.42) | ALDH1A1PTGS2 | |
| SCHEMBL22043367 | 0.69 | ALDH1A1 (0.39) | ALDH1A1CA1CA2PTGS2 | |
| SCHEMBL8415344 | 0.67 | ALDH1A1 (0.46) | ALDH1A1CA1CA2CRHR1TAAR1 | |
| SCHEMBL20122628 | 0.67 | AOC3 (0.47) | ALDH1A1CA1CA2TAAR1 | |
| SCHEMBL3006255 | 0.66 | ALDH1A1 (0.50) | ALDH1A1CA1CA2HSP90AA1HSP90AB1 | |
| SCHEMBL9171904 | 0.66 | ALDH1A1 (0.43) | ALDH1A1CA1CA2CRHR1TAAR1 | |
| SCHEMBL14107749 | 0.66 | SLC6A4 (0.40) | ALDH1A1CA1CA2HSP90AA1HSP90AB1 | |
| SCHEMBL1047515 | 0.65 | ALDH1A1 (0.56) | ALDH1A1CA1CA2 | |
| SCHEMBL4891293 | 0.65 | ALDH1A1 (0.48) | ALDH1A1CA1CA2HSP90AA1HSP90AB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0157267-B1 | SUBSTITUTED BENZOPYRANS, PROCESS FOR THEIR PREPARATION AND THEIR USE IN MEDICINES | BAYER AG (DE) | 1988-11-23 | — | — | EP | disclosed |
| US-4659737-A | Substituted aminomethyl benzopyrans having anti-hypertensive activities | BAYER AKTIENGESELLSCHAFT (DE) | 1987-04-21 | — | — | US | disclosed |
| US-4647579-A | Circulation active novel substituted 4-hydroxy-benzopyrans | BAYER AKTIENGESELLSCHAFT (DE) | 1987-03-03 | — | — | US | disclosed |