Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 3/20 | 0.37 |
| ▸ | AGTR2 | P50052 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.36 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ACE | P12821 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8905804 | 0.95 | KDM4E (0.40) | AGTR1AGTR2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL8905618 | 0.93 | KDM4E (0.38) | AGTR1AGTR2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL8905214 | 0.91 | PPARG (0.37) | AGTR1AGTR2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL8905755 | 0.89 | AGTR1 (0.33) | AGTR1AGTR2 | |
| SCHEMBL8905546 | 0.88 | CYP3A4 (0.34) | AGTR1AGTR2CYP3A4CYP2C9 | |
| SCHEMBL8906812 | 0.87 | ALDH1A1 (0.39) | KDM4EALDH1A1HSD17B10CYP3A4TP53 | |
| SCHEMBL8905230 | 0.86 | KDM4E (0.35) | AGTR1AGTR2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL8906938 | 0.86 | AGTR1 (0.32) | AGTR1AGTR2 | |
| SCHEMBL8907620 | 0.86 | AGTR1 (0.38) | AGTR1AGTR2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL8905936 | 0.85 | GPR119 (0.35) | — |
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-5684029-A | HYPOTENSIVE AGENTS | KARL THOMAE GMBH (DE) | 1997-11-04 | — | — | US | disclosed |