Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCGR | P47871 | 4/20 | 0.44 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.40 |
| ▸ | BID | P55957 | 3/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.39 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.39 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | EP300 | Q09472 | 1/20 | 0.39 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.39 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.39 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.39 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.39 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4630200 | 0.98 | SOAT1 (0.44) | GCGRSOAT1HSD11B1PTPN1BID | |
| SCHEMBL4630068 | 0.95 | PSMB5 (0.41) | GCGRSOAT1HSD11B1PTPN1PDCD1 | |
| SCHEMBL5555116 | 0.88 | GCGR (0.50) | GCGRSOAT1HSD11B1PTPN1GPR84 | |
| SCHEMBL6546895 | 0.83 | GCGR (0.47) | GCGRSOAT1HSD11B1PTPN1GPR84 | |
| SCHEMBL9650756 | 0.82 | BID (0.48) | GCGRSOAT1PTPN1BIDMCL1 | |
| SCHEMBL1024527 | 0.81 | PDCD1 (0.47) | GCGRHSD11B1GPR84BIDMCL1 | |
| SCHEMBL4629930 | 0.80 | PDCD1 (0.40) | GCGRBCL2L1PDCD1CD274 | |
| SCHEMBL1841356 | 0.80 | GCGR (0.49) | GCGRSOAT1HSD11B1BIDMCL1 | |
| SCHEMBL8157125 | 0.80 | PPARA (0.49) | GCGRSOAT1BIDMCL1BCL2L1 | |
| SCHEMBL1921651 | 0.80 | PPARA (0.49) | GCGRSOAT1BIDMCL1BCL2L1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1919907-A2 | HETEROCYCLIC COMPOUND | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2008-05-14 | — | — | EP | disclosed |
| WO-2007026959-A2 | DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2007-03-08 | — | — | WO | disclosed |