Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | LAP3 | P28838 | 1/20 | 0.43 |
| ▸ | CPA1 | P15085 | 2/20 | 0.42 |
| ▸ | CPA3 | P15088 | 2/20 | 0.42 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.42 |
| ▸ | CPB1 | P15086 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9325914 | 1.00 | ALDH1A1 (0.49) | ALDH1A1CYP1A2MAPK1L3MBTL1SLC6A2 | |
| SCHEMBL7300596 | 1.00 | ALDH1A1 (0.49) | ALDH1A1CYP1A2MAPK1L3MBTL1SLC6A2 | |
| SCHEMBL7278235 | 0.89 | CYP1A2 (0.52) | ALDH1A1CYP1A2MAPK1L3MBTL1SLC6A2 | |
| SCHEMBL7141356 | 0.87 | EPHX2 (0.51) | ALDH1A1CYP1A2L3MBTL1KMT2ACPA1 | |
| Hydrochloric Acid SCHEMBL7420885 | 0.85 | EPHX2 (0.50) | ALDH1A1CYP1A2L3MBTL1KMT2ACPA1 | |
| SCHEMBL7332197 | 0.85 | KMT2A (0.50) | ALDH1A1CYP1A2KMT2ACA12CA1 | |
| SCHEMBL4816041 | 0.84 | HSD17B10 (0.48) | ALDH1A1ELANE | |
| SCHEMBL21811160 | 0.82 | CYP1A2 (0.59) | ALDH1A1CYP1A2MAPK1L3MBTL1SLC6A2 | |
| SCHEMBL7282736 | 0.81 | CPA3 (0.48) | ALDH1A1CYP1A2CTRB1CPA1CPA3 | |
| SCHEMBL4610145 | 0.81 | ITGA4 (0.44) | ALDH1A1CYP1A2KMT2ATDP1CA12 |
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-0417698-B1 | Amino acid derivatives having renin-inhibiting activity, process for their preparation, agents containing them, and their use | HOECHST AG (DE) | 1996-03-13 | — | — | EP | disclosed |
| US-5374731-A | Treatment of high blood pressure, congestive heart failure and viral disorders | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-12-20 | — | — | US | disclosed |
| EP-0417698-A2 | Amino acid derivatives having renin-inhibiting activity, process for their preparation, agents containing them, and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-03-20 | — | — | EP | disclosed |