Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.62 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.62 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 5/20 | 0.56 |
| ▸ | RAB9A | P51151 | 5/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.55 |
| ▸ | RELA | Q04206 | 3/20 | 0.55 |
| ▸ | LSS | P48449 | 1/20 | 0.55 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.53 |
| ▸ | LTA4H | P09960 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7295162 | 0.87 | NR1H4 (0.59) | NR1H4S1PR1S1PR3NPC1RAB9A | |
| SCHEMBL7962298 | 0.87 | NPC1 (0.64) | NR1H4S1PR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4875581 | 0.85 | NPC1 (0.54) | NR1H4S1PR1S1PR3NPC1RAB9A | |
| SCHEMBL7294317 | 0.83 | NPC1 (0.61) | NR1H4S1PR1S1PR3NPC1RAB9A | |
| SCHEMBL7963733 | 0.82 | HTR7 (0.54) | NR1H4S1PR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5736045 | 0.81 | HTR7 (0.63) | NR1H4S1PR1NPC1RAB9ASMN1; SMN2 | |
| Irampanel SCHEMBL678128 | 0.81 | HTR7 (0.63) | NPC1RAB9ASMN1; SMN2MAPTHTT | |
| SCHEMBL7957270 | 0.80 | TTR (0.61) | S1PR1NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL22831331 | 0.80 | LSS (0.83) | NPC1RAB9AMAPTCXCR1LSS | |
| Irampanel SCHEMBL6879876 | 0.80 | HTR7 (0.62) | NPC1RAB9ASMN1; SMN2MAPTHTT |
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-6277872-B1 | ANTIISCHEMIC AGENTS; BRAIN DISORDERS | BOEHRINGER INGELHEIM KG (DE) | 2001-08-21 | — | — | US | disclosed |