Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.42 |
| ▸ | SYK | P43405 | 1/20 | 0.42 |
| ▸ | METAP2 | P50579 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.40 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.40 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 2/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL20525475 | 0.93 | JAK1 (0.47) | DRD2SYKCHRM4JAK1DRD4 | |
| SCHEMBL20525477 | 0.91 | PRKAA2 (0.45) | PIK3CAPRKAA2EGLN1JAK1 | |
| SCHEMBL20525400 | 0.90 | PARP1 (0.41) | MCHR1EGLN1CCR5 | |
| SCHEMBL20525358 | 0.90 | EGLN1 (0.42) | SYKEGLN1CCR5 | |
| SCHEMBL20525454 | 0.89 | SYK (0.42) | SYKEGLN1 | |
| SCHEMBL20525469 | 0.88 | PIK3CA (0.42) | PIK3CAPRKAA2EGLN1DRD4 | |
| SCHEMBL20525317 | 0.88 | EGLN1 (0.39) | SYKEGLN1CCR5 | |
| SCHEMBL20525339 | 0.86 | PARP1 (0.41) | MCHR1EGLN1JAK1 | |
| SCHEMBL20525424 | 0.86 | EGLN1 (0.38) | SYKEGLN1CCR5 | |
| SCHEMBL20525414 | 0.85 | PARP1 (0.42) | EGLN1CCR5DRD4ACHE |
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-3080125-B1 | NOVEL AZAINDOLE DERIVATIVES AS SELECTIVE HISTONE DEACETYLASE (HDAC) INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP (KR) | 2018-10-10 | — | — | EP | disclosed |