Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.45 |
| ▸ | CRHR1 | P34998 | 15/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 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 | |
|---|---|---|---|---|
| SCHEMBL3436656 | 0.88 | HSP90AA1 (0.46) | HSP90AA1HSP90AB1CRHR1ADORA2B | |
| SCHEMBL19936567 | 0.84 | HSP90AA1 (0.43) | HSP90AA1HSP90AB1CRHR1GRM5ADORA2B | |
| SCHEMBL14805079 | 0.77 | CYP1A2 (0.42) | CRHR1GRM5 | |
| SCHEMBL19936425 | 0.77 | HSP90AA1 (0.46) | HSP90AA1HSP90AB1CRHR1ADORA2B | |
| SCHEMBL19936646 | 0.76 | CRHR1 (0.42) | HSP90AA1HSP90AB1CRHR1GRM5ADORA2B | |
| SCHEMBL14805082 | 0.75 | HTR2A (0.45) | — | |
| SCHEMBL3436592 | 0.75 | CYP1A2 (0.44) | HSP90AA1HSP90AB1CRHR1 | |
| SCHEMBL10049095 | 0.74 | HSP90AA1 (0.43) | HSP90AA1HSP90AB1CRHR1ADORA2B | |
| SCHEMBL19936645 | 0.73 | ESRRA (0.41) | CRHR1 | |
| SCHEMBL3436659 | 0.72 | ACHE (0.40) | CRHR1 |
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-2594555-B1 | HETEROCYCLIC COMPOUND, AND p27 KIP1 DEGRADATION INHIBITOR | ASKA PHARM CO LTD (JP) | 2018-03-07 | — | — | EP | disclosed |