Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 11/20 | 0.43 |
| ▸ | HNF4A | P41235 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.36 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | VCP | P55072 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 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 | |
|---|---|---|---|---|
| SCHEMBL11808810 | 0.84 | PTGDR2 (0.36) | FFAR1ALDH1A1GABRPGABRDGABRA1 | |
| SCHEMBL11812891 | 0.84 | FFAR1 (0.35) | FFAR1HNF4AALDH1A1MAPTGABRP | |
| SCHEMBL11808626 | 0.84 | FFAR1 (0.43) | FFAR1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL11809121 | 0.77 | FFAR1 (0.43) | FFAR1HNF4ANPSR1HSP90AA1S1PR2 | |
| SCHEMBL11809459 | 0.77 | FFAR1 (0.47) | FFAR1MAPTNPC1RAB9A | |
| Benzene SCHEMBL28174766 | 0.77 | NPSR1 (0.59) | FFAR1NPSR1HSP90AA1ALDH1A1MAPT | |
| SCHEMBL68968 | 0.77 | NPSR1 (0.59) | FFAR1NPSR1HSP90AA1ALDH1A1MAPT | |
| SCHEMBL9629232 | 0.76 | FFAR1 (0.50) | FFAR1NPSR1HSP90AA1ALDH1A1VCP | |
| SCHEMBL6554023 | 0.74 | NPSR1 (0.63) | FFAR1NPSR1HSP90AA1ALDH1A1MAPT | |
| SCHEMBL6553632 | 0.74 | NPSR1 (0.57) | FFAR1NPSR1HSP90AA1ALDH1A1MAPT |
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-3987116-A | ETHYNYLARYL COMPOUNDS AND DERIVATIVES THEREOF | WILLIAM H. RORER, INC. (US) | 1976-10-19 | — | — | US | disclosed |