Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19778948 | 0.77 | ESR1 (0.33) | ESR1 | |
| SCHEMBL3418234 | 0.74 | LMNA (0.45) | HRH4ESR1 | |
| SCHEMBL12257760 | 0.72 | HRH4 (0.53) | HRH4ESR1 | |
| SCHEMBL18063484 | 0.68 | NPC1 (0.51) | HRH4 | |
| SCHEMBL2721824 | 0.67 | HRH4 (0.49) | HRH4 | |
| SCHEMBL29438115 | 0.67 | HRH4 (0.49) | HRH4 | |
| SCHEMBL10157693 | 0.65 | KMT2A (0.39) | HRH4ESR1 | |
| SCHEMBL25530093 | 0.64 | HRH4 (0.46) | HRH4 | |
| SCHEMBL179341 | 0.64 | HRH4 (0.46) | HRH4 | |
| SCHEMBL23592933 | 0.63 | ATF1 (0.41) | — |
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-2010028179-A1 | HETEROCYCLIC COMPOUNDS AS GATA MODULATORS | DR. REDDY'S LABORATORIES LTD. (IN) | 2010-03-11 | — | — | WO | disclosed |