Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 2/20 | 0.38 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.35 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.35 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8905808 | 0.95 | ALDH1A1 (0.39) | AGTR1AGTR2TP53KDM4EALDH1A1 | |
| SCHEMBL8905630 | 0.93 | KDM4E (0.39) | AGTR1AGTR2TP53KDM4EALDH1A1 | |
| SCHEMBL8905217 | 0.90 | KDM4E (0.37) | AGTR1AGTR2TP53KDM4EALDH1A1 | |
| SCHEMBL8905761 | 0.88 | AGTR1 (0.33) | AGTR1AGTR2 | |
| SCHEMBL8905553 | 0.87 | AGTR1 (0.33) | AGTR1AGTR2CYP3A4CYP2C9 | |
| SCHEMBL8906823 | 0.86 | ALDH1A1 (0.41) | TP53KDM4EALDH1A1HSD17B10NPC1 | |
| SCHEMBL8905237 | 0.86 | KDM4E (0.36) | AGTR1AGTR2TP53KDM4EALDH1A1 | |
| SCHEMBL8907613 | 0.86 | AGTR1 (0.37) | AGTR1AGTR2TP53KDM4EALDH1A1 | |
| SCHEMBL8906946 | 0.85 | AGTR1 (0.33) | AGTR1AGTR2 | |
| SCHEMBL8906974 | 0.84 | AGTR1 (0.32) | AGTR1AGTR2 |
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 |