Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.46 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 6/20 | 0.37 |
| ▸ | PPARA | Q07869 | 6/20 | 0.37 |
| ▸ | LTB4R | Q15722 | 3/20 | 0.37 |
| ▸ | LTB4R2 | Q9NPC1 | 3/20 | 0.37 |
| ▸ | PTGES | O14684 | 3/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.37 |
| ▸ | PPARD | Q03181 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL7979062 | 0.88 | ABCB1 (0.54) | ABCB1MRGPRX4ALDH1A1GAAADRB2 | |
| SCHEMBL7972957 | 0.81 | ADRB2 (0.57) | ABCB1MRGPRX4ALDH1A1GAAADRB2 | |
| SCHEMBL7976448 | 0.80 | KDM4E (0.36) | ABCB1ALDH1A1HTTPPARGPPARA | |
| SCHEMBL4817908 | 0.79 | ABCB1 (0.50) | ABCB1MRGPRX4ALDH1A1GAAADRB2 | |
| SCHEMBL7528817 | 0.78 | ABCB1 (0.50) | ABCB1MRGPRX4ALDH1A1GAAADRB2 | |
| SCHEMBL7972678 | 0.77 | ALDH1A1 (0.45) | ABCB1MRGPRX4ALDH1A1GAAADRB2 | |
| SCHEMBL11127019 | 0.77 | ABCB1 (0.53) | ABCB1MRGPRX4ALDH1A1GAAADRB2 | |
| SCHEMBL8460122 | 0.77 | LTB4R (0.49) | ABCB1MRGPRX4ALDH1A1GAATSHR | |
| SCHEMBL28346647 | 0.76 | ABCB1 (0.53) | ABCB1MRGPRX4ALDH1A1GAAADRB2 | |
| SCHEMBL24510647 | 0.75 | ABCB1 (0.52) | ABCB1MRGPRX4ALDH1A1GAAADRB2 |
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-6248766-B1 | CARDIOVASCULAR DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-06-19 | — | — | US | disclosed |