Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCGR | P47871 | 6/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.31 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | MC4R | P32245 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4042167 | 0.92 | GCGR (0.49) | GCGRTP53MAPTNPSR1SAE1 | |
| SCHEMBL4040885 | 0.91 | GCGR (0.50) | GCGRTP53MAPTNPSR1SAE1 | |
| SCHEMBL4044047 | 0.90 | GCGR (0.51) | GCGRTP53MAPTNPSR1SAE1 | |
| SCHEMBL4042323 | 0.89 | GCGR (0.50) | GCGRTP53MAPTNPSR1SAE1 | |
| SCHEMBL4041844 | 0.88 | GCGR (0.46) | GCGRTP53MAPTNPSR1SAE1 | |
| SCHEMBL4037348 | 0.88 | GCGR (0.60) | GCGRTP53MAPTNPSR1SAE1 | |
| SCHEMBL4043997 | 0.88 | GCGR (0.49) | GCGRTP53MAPTNPSR1SAE1 | |
| SCHEMBL4044279 | 0.88 | GCGR (0.47) | GCGRTP53MAPTNPSR1SAE1 | |
| SCHEMBL4039828 | 0.88 | GCGR (0.46) | GCGRTP53MAPTNPSR1SAE1 | |
| SCHEMBL4039156 | 0.87 | GCGR (0.47) | GCGRTP53CYP1A2CYP3A4MAPT |
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 |