Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 8/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.46 |
| ▸ | PPARG | P37231 | 3/20 | 0.46 |
| ▸ | PPARA | Q07869 | 3/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL31447805 | 0.90 | CCR1 (0.44) | CCR1SLC6A2SLC6A4SLC6A3PPARG | |
| SCHEMBL1344083 | 0.89 | KCNH2 (0.46) | CCR1SLC6A2SLC6A4SLC6A3CNR1 | |
| SCHEMBL8938075 | 0.84 | CCR1 (0.47) | CCR1SLC6A2SLC6A4SLC6A3PPARG | |
| SCHEMBL10833080 | 0.82 | ESR1 (0.44) | CCR1ALDH1A1 | |
| SCHEMBL5054960 | 0.80 | ESR2 (0.56) | CCR1SLC6A2SLC6A4SLC6A3PPARG | |
| SCHEMBL29171617 | 0.80 | CCR1 (0.51) | CCR1ALDH1A1 | |
| SCHEMBL27839427 | 0.79 | CCR1 (0.49) | CCR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL10817892 | 0.78 | CCR1 (0.42) | CCR1SLC6A2SLC6A4SLC6A3PPARG | |
| SCHEMBL1343597 | 0.78 | ACP3 (0.44) | SLC6A2SLC6A4SLC6A3CYP19A1ALDH1A1 | |
| SCHEMBL9804979 | 0.77 | CCR1 (0.49) | CCR1SLC6A2SLC6A4SLC6A3ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0445698-B1 | Thiocarbamoylacetonitrile compounds | MITSUBISHI CHEM IND (JP) | 1994-06-22 | — | — | EP | disclosed |
| US-5246958-A | Thiocarbamoylacetonitriles | MITSUBISHI KASEI CORPORATION (JP) | 1993-09-21 | — | — | US | disclosed |
| EP-0445698-A1 | Thiocarbamoylacetonitrile compounds | MITSUBISHI KASEI CORPORATION (JP) | 1991-09-11 | — | — | EP | disclosed |