Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 3/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | SETD7 | Q8WTS6 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | FPR3 | P25089 | 1/20 | 0.35 |
| ▸ | GPR65 | Q8IYL9 | 1/20 | 0.35 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4185696 | 0.89 | CCR1 (0.43) | CCR1GPR119MGLLSETD7MAP4K4 | |
| SCHEMBL4609198 | 0.88 | CCR1 (0.40) | CCR1GPR119MGLLSETD7MAP4K4 | |
| SCHEMBL9965293 | 0.87 | CCR1 (0.42) | CCR1GPR119MGLLSETD7MAP4K4 | |
| SCHEMBL1704127 | 0.84 | CCR1 (0.41) | CCR1GPR119MGLLALDH1A1KDM4E | |
| SCHEMBL1704705 | 0.83 | PTGDR2 (0.44) | CCR1GPR119MGLLALDH1A1SETD7 | |
| SCHEMBL29269208 | 0.82 | CCR1 (0.47) | CCR1GPR119MGLLSETD7MAP4K4 | |
| SCHEMBL29269207 | 0.82 | CCR1 (0.47) | CCR1GPR119MGLLSETD7MAP4K4 | |
| SCHEMBL29269210 | 0.82 | CCR1 (0.47) | CCR1GPR119MGLLSETD7MAP4K4 | |
| SCHEMBL13954897 | 0.82 | CCR1 (0.59) | CCR1PTGDR2FPR3GPR65GPR35 | |
| SCHEMBL377466 | 0.82 | CCR1 (0.46) | CCR1GPR119MGLLSETD7MAP4K4 |
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-2441763-A1 | Benzylpiperazine derivatives useful for the treatment of gastrointestinal disorders | Glaxo Group Limited (GB) | 2012-04-18 | — | — | EP | disclosed |