Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.39 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GCGR | P47871 | 2/20 | 0.36 |
| ▸ | MGLL | Q99685 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4042505 | 0.88 | ALDH1A1 (0.40) | ALDH1A1MAPTNPSR1SAE1UBA2 | |
| SCHEMBL6315675 | 0.78 | NPC1 (0.35) | ALDH1A1MAPTNPSR1SAE1UBA2 | |
| SCHEMBL4038702 | 0.77 | MAPT (0.38) | ALDH1A1MAPTNPSR1SAE1UBA2 | |
| SCHEMBL4040360 | 0.76 | GCGR (0.49) | ALDH1A1MAPTNPSR1SAE1UBA2 | |
| SCHEMBL4045354 | 0.76 | GCGR (0.40) | ALDH1A1MAPTNPSR1SAE1UBA2 | |
| SCHEMBL4046896 | 0.76 | GCGR (0.37) | ALDH1A1MAPTNPSR1SAE1UBA2 | |
| SCHEMBL4045769 | 0.76 | TP53 (0.35) | ALDH1A1MAPTNPSR1SAE1UBA2 | |
| SCHEMBL4041573 | 0.76 | GCGR (0.61) | ALDH1A1MAPTNPSR1SAE1UBA2 | |
| SCHEMBL4041950 | 0.76 | MAPT (0.36) | ALDH1A1MAPTNPSR1SAE1UBA2 | |
| SCHEMBL4043069 | 0.75 | GCGR (0.43) | ALDH1A1MAPTNPSR1SAE1UBA2 |
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-1549655-B1 | SUBSTITUTED BICYCLIC THIOPHENE DERIVATIVES, COMPOSTIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE | MERCK & CO INC (US) | 2009-01-21 | — | — | EP | claimed |