Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.32 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 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 | |
|---|---|---|---|---|
| SCHEMBL7343566 | 0.82 | ALDH1A1 (0.36) | ALDH1A1CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL4721832 | 0.81 | — | — | |
| SCHEMBL28420033 | 0.79 | ALDH1A1 (0.46) | ALDH1A1CHRNB2CHRNB4CHRNA4HSD17B10 | |
| SCHEMBL622807 | 0.79 | — | — | |
| SCHEMBL1191256 | 0.78 | ALDH1A1 (0.63) | ALDH1A1CHRNB2CHRNB4CHRNA4HSD17B10 | |
| SCHEMBL15388067 | 0.74 | ALDH1A1 (0.41) | ALDH1A1CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL8835976 | 0.74 | ALDH1A1 (0.52) | ALDH1A1CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL8064060 | 0.74 | ALDH1A1 (0.41) | ALDH1A1CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL131476 | 0.73 | ALDH1A1 (0.74) | ALDH1A1CHRNB2CHRNB4CHRNA4PHF8 | |
| SCHEMBL5948495 | 0.73 | ALDH1A1 (0.74) | ALDH1A1CHRNB2CHRNB4CHRNA4HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0716077-A1 | Aromatically substituted omega amino alcanoic acid amides and alcanoic diamides and their use as renine inhibitors | CIBA-GEIGY AG (CH) | 1996-06-12 | — | — | EP | disclosed |
| EP-0678503-A1 | Delta-amino-gamma-hydroxy-omega-aryl alkanoic acid amides with enzyme especially renin inhibiting activities | CIBA-GEIGY AG (CH) | 1995-10-25 | — | — | EP | disclosed |