Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29169707 | 0.98 | ALDH1A1 (0.48) | ALDH1A1HSD17B10HPGDMEN1KMT2A | |
| SCHEMBL24776367 | 0.83 | ALDH1A1 (0.52) | ALDH1A1HSD17B10HPGDCYP1A2CYP2C19 | |
| SCHEMBL29169693 | 0.80 | CYP1A2 (0.36) | ALDH1A1HSD17B10HPGDMEN1KMT2A | |
| Lithium Ion SCHEMBL9780243 | 0.78 | CYP3A4 (0.45) | ALDH1A1HSD17B10HPGDMEN1KMT2A | |
| SCHEMBL9156598 | 0.75 | HSD17B10 (0.42) | ALDH1A1HSD17B10MEN1KMT2ACYP1A2 | |
| SCHEMBL27171684 | 0.75 | PTPN22 (0.52) | ALDH1A1HSD17B10HPGDKDM4ECYP1A2 | |
| SCHEMBL19432647 | 0.72 | TRPM4 (0.48) | ALDH1A1HSD17B10HPGDMEN1KMT2A | |
| SCHEMBL9914783 | 0.72 | HDAC4 (0.42) | CYP1A2CYP2C19HIF1ACYP1B1ALOX5 | |
| SCHEMBL12213109 | 0.70 | CA1 (0.47) | ALDH1A1HSD17B10HPGDMEN1KMT2A | |
| SCHEMBL20664585 | 0.69 | ALDH1A1 (0.44) | ALDH1A1HSD17B10HPGDMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5030631-A | Hypotensive, bronchodilator agents | SCHERING CORPORATION (US) | 1991-07-09 | — | — | US | disclosed |