Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.47 |
| ▸ | FDFT1 | P37268 | 3/20 | 0.40 |
| ▸ | THRA | P10827 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 2/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | TEK | Q02763 | 1/20 | 0.38 |
| ▸ | KDM4B | O94953 | 1/20 | 0.38 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.38 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL723499 | 0.79 | HTT (0.43) | ALDH1A1HTTCYSLTR1 | |
| SCHEMBL723442 | 0.77 | EGFR (0.44) | CYSLTR1 | |
| SCHEMBL723189 | 0.74 | ALDH1A1 (0.54) | NPC1ALDH1A1MAPTHPGDTSHR | |
| SCHEMBL723378 | 0.72 | CYP3A4 (0.47) | NPC1ALDH1A1MAPTHPGDTSHR | |
| SCHEMBL723784 | 0.72 | ALDH1A1 (0.53) | NPC1ALDH1A1MAPTHPGDTSHR | |
| SCHEMBL721424 | 0.71 | MAOB (0.42) | ALDH1A1MAPTLCKKDRCYSLTR1 | |
| SCHEMBL721852 | 0.71 | BTK (0.47) | NPC1ALDH1A1MAPTHPGDHTT | |
| SCHEMBL721853 | 0.71 | BTK (0.47) | NPC1ALDH1A1MAPTHPGDHTT | |
| SCHEMBL725600 | 0.71 | BTK (0.49) | NPC1ALDH1A1MAPTTSHRNPSR1 | |
| SCHEMBL722213 | 0.70 | BTK (0.59) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2609100-B1 | FUROPYRIDINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2015-06-24 | — | — | EP | claimed |