Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.37 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | MAP3K14 | Q99558 | 2/20 | 0.33 |
| ▸ | AHR | P35869 | 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 | |
|---|---|---|---|---|
| SCHEMBL17522841 | 0.77 | PIK3CA (0.41) | PIK3CAPIK3CBPIK3CGPIK3CD | |
| SCHEMBL4512434 | 0.70 | KMT2A (0.38) | HTR2AHTR2C | |
| SCHEMBL903681 | 0.70 | PIK3CA (0.34) | HTR2AHTR2CPIK3CAPIK3CBPIK3CG | |
| SCHEMBL17429552 | 0.67 | ACLY (0.34) | — | |
| SCHEMBL17429734 | 0.67 | ACLY (0.34) | — | |
| SCHEMBL14764759 | 0.64 | PIK3CA (0.37) | PIK3CAPIK3CBPIK3CGPIK3CD | |
| SCHEMBL9735949 | 0.64 | HTR2A (0.45) | HTR2AHTR2CAHR | |
| SCHEMBL10217252 | 0.62 | PIK3CA (0.38) | PIK3CAPIK3CBPIK3CGPIK3CD | |
| SCHEMBL15804615 | 0.62 | PIK3CA (0.37) | PIK3CAPIK3CBPIK3CGPIK3CD | |
| SCHEMBL6492730 | 0.61 | HSD11B1 (0.50) | AHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012041014-A1 | TETRACYCLIC INDOLE DERIVATIVES FOR TREATING HEPATITIS C VIRUS INFECTION | MERCK SHARP & DOHME CORP. (US) | 2012-04-05 | — | — | WO | disclosed |