Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL16700414 | 0.84 | NR1H2 (0.33) | ALDH1A1 | |
| SCHEMBL16697373 | 0.81 | MAP4K4 (0.35) | ALDH1A1 | |
| SCHEMBL16701000 | 0.78 | ADORA1 (0.31) | — | |
| SCHEMBL16700086 | 0.76 | ADORA1 (0.36) | ALDH1A1 | |
| SCHEMBL16711396 | 0.75 | BTK (0.35) | ALDH1A1 | |
| SCHEMBL18184012 | 0.74 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL16711114 | 0.72 | ADORA1 (0.37) | ALDH1A1 | |
| SCHEMBL16711379 | 0.71 | MAP4K4 (0.36) | — | |
| SCHEMBL16728665 | 0.70 | MAP4K4 (0.34) | ALDH1A1 | |
| SCHEMBL16699166 | 0.70 | ADORA1 (0.44) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9598423-B2 | Substituted 4,5,6,7-tetrahydropyrazolo[1,5-A]pyrazine derivatives as casein kinase 1 D/E inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-03-21 | — | — | US | disclosed |