Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.39 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 17/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | BRD2 | P25440 | 1/20 | 0.34 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.34 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5224159 | 0.85 | GPR55 (0.43) | GPR55NSD3BRD4CREBBPBRD2 | |
| SCHEMBL5228026 | 0.85 | HTR1A (0.42) | GPR55NSD3BRD4CREBBPBRD2 | |
| SCHEMBL2001557 | 0.83 | KCNH2 (0.37) | — | |
| SCHEMBL5223627 | 0.83 | GPR55 (0.42) | GPR55NSD3BRD4CREBBP | |
| SCHEMBL5227625 | 0.79 | HTR7 (0.37) | — | |
| SCHEMBL5228031 | 0.78 | MAPK1 (0.40) | — | |
| SCHEMBL5225128 | 0.76 | NSD3 (0.45) | GPR55NSD3BRD4CREBBP | |
| SCHEMBL5907357 | 0.76 | HTR1A (0.39) | — | |
| SCHEMBL2000118 | 0.75 | KCNH2 (0.33) | — | |
| SCHEMBL2003026 | 0.74 | GSK3B (0.33) | — |
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-1611122-B1 | SUBSTITUTED PYRAZOLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-06-13 | — | — | EP | disclosed |